Building Blocks

Methyl 3-[Hydroxy[4-(trifluoromethyl)phenyl]methyl]isoxazole-4-carboxylate

Versatile small molecule scaffold

Versatile small molecule scaffold

3-Cyclopropylalanine (3-CPA) is a synthetic amino acid that is used as an enzyme inhibitor for the treatment of metabolic disorders and cancer. 3-CPA inhibits the activity of ns3 protease, which is involved in the production of malonic acid from succinate. The hydrogenated form of 3-CPA has been shown to inhibit protease activity, especially in diagnostic agents. 3-CPA can also be used as a catalyst for chemical reactions and when synthesized as a stable complex with enantiomers, it can be used as a diagnostic agent.

2-Iodoquinoxaline is a heterocyclic compound that contains an ethyl diazoacetate group. It can be synthesised from chloroformate and ferredoxin, which are both five-membered rings. 2-Iodoquinoxaline is used to make other heterocyclic compounds, such as the phosphonium salt and the dioxolane. This molecule has also been shown to be a good acceptor for evaporation of liquids. When exposed to radiation, 2-iodoquinoxaline converts into a molybdenum (Mo) molecule, which is important in the synthesis of many organic compounds. This compound can also be synthesized by reacting styrene with olefinic molecules under appropriate conditions.

Versatile small molecule scaffold

Versatile small molecule scaffold

1-(3-Allyl-2,4-dihydroxyphenyl)ethanone is a chemical compound that is used as an intermediate in the production of other chemicals. It is a high-purity, hydrate form of 1-(3-allyl-2,4-dihydroxyphenyl)ethanone. It can be prepared by reacting sodium hydroxide with allyl chloride in an alkaline solution. Sodium hydroxide and allyl chloride react to form sodium allylate and 1-(3-allyl-2,4-dihydroxyphenyl)ethanone. The reaction produces a high yield of 1-(3-allyl-2,4-dihydroxyphenyl)ethanone and has been shown to have protonic properties.

Versatile small molecule scaffold

Thalidomide is a research tool that is used to study the function of proteins and peptides. It can also be used to study ion channels, cell biology, and pharmacology. Thalidomide has been shown to bind to receptor proteins and activate them by binding to the ligand-binding site. Thalidomide inhibits certain types of ion channels in nerve cells. It also binds with high affinity to antibodies, which may have therapeutic applications for autoimmune diseases.

Azepan-4-one, N-BOC protected

Versatile small molecule scaffold

Versatile small molecule scaffold

1,1-Dimethyl 2-ethenylcyclopropane-1,1-dicarboxylate is an organocatalyst that is used for the allylation of aliphatic alcohols. It has a chiral centre and can be used to produce optically active compounds. It reacts with aliphatic aldehydes in the presence of sodium dicarbonate to form enamines, which are then ring-opened with malonates to yield dienones. This process can be used to produce vinyl ethers from alcohols and vinylcyclopropanes from acetylene. The yields are moderate and the reaction requires high temperatures (120°C).

tert-Butyl 4-propionylpiperidine-1-carboxylate

5-Bromobenzo[b]thiophene-3-carboxylic acid

Versatile small molecule scaffold

Versatile small molecule scaffold

4-Methylisothiazole-5-carboxaldehyde

Versatile small molecule scaffold

2,2-Pentamethylenebenzothiazoline is a cleaving agent. It is used as an intermediate for the production of tranquilizers and other drugs. 2,2-Pentamethylenebenzothiazoline can be used as an analog for benzothiazine and phenothiazine. It also has the ability to cleave ring structures, which may be due to its alkylating properties.

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Benzyl 3-aminobenzoate is an amide that has a pharmacophore with the calixarenes, which are aromatic hydrocarbons that have a rigid carbon framework. Benzyl 3-aminobenzoate is a pseudopeptide, which means it has an amide bond and contains both amino acids and peptide bonds. It is composed of three subunits, each with a different function. The first subunit binds to the bile acid receptor in the liver and prevents the excretion of bile acids. The second subunit binds to the enzyme that synthesizes cyclic peptides and prevents its activity. The third subunit binds to the enzyme that produces cholesterol in order to prevent its production. Benzyl 3-aminobenzoate is scalable because it can be synthesized on a large scale at low cost through a ternary complex process involving hydrogenation, crystallization, and molecule modeling.

4-tert-Butylcyclohexane-1-carbonitrile is a versatile chemical that can be used as a reagent in organic synthesis. It is a Grignard reagent, which is an alkoxide of magnesium that reacts with an alkyl halide to form an alcohol or an ether. The 4-tert-butylcyclohexane-1-carbonitrile can also be used for the arylation of ketones and for the stereospecific alkylation of primary amines. This compound has been shown to be effective in the deprotonation of tertiary amines and in the formation of cyclic carbonates. The nature of this molecule is chiral, giving it two possible structures: (R) and (S).

4-(Azetidin-3-yl)thiomorpholine 1,1-dioxide hydrochloride

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

1-Ethyl-1H-indole-4-carbaldehyde

Ethyl 2,6-dichloropyrimidine-4-carboxylate is a synthetic molecule with a molecular weight of 204. It has a propiolic group and two phenylamino groups that are attached by a cyanogen bridge. This compound has been synthesized for use in the production of polyethylene terephthalate. It is not used as an antibiotic. The chlorine atoms are located on the pyrimidine ring and can be substituted with other halogens, such as bromine or iodine. It is soluble in chloroacetic acid and alicyclic solvents but insoluble in dimethoxybenzene, naphthol, or trimethylsulfonium chloride. It also reacts with acetone to form a residue that contains cyanuric acid.

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

6-Phenyl-5-(piperazin-1-yl)pyridazin-3(2H)-one

Versatile small molecule scaffold

3-(3-Bromo-2-thienyl)-1-propene is a heterocyclic compound that is produced by the catalyzed reaction of 3-bromo-2-thiophene with propene. It has linear and bicyclic structures, with the linear form being more stable. 3-(3-Bromo-2-thienyl)-1-propene can be used in Buchwald-Hartwig amination reactions to produce a variety of substituted pyridines. The regioselective nature of this reaction allows for the synthesis of many different types of pyridines with high regioselectivity. 3-(3-Bromo-2-thienyl)-1-propene also has high regioselectivity in its synthesis, which allows for the production of either bicyclic or tetrahydropyridine products depending on conditions.

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

2,3-Difluoropyridine-5-boronic acid, pinacol ester

2-(3-Fluorophenyl)amino-5-(salicylamid-5yl)-1,3-thiazole

Versatile small molecule scaffold

Versatile small molecule scaffold

2-Ethyl-3-hydroxybutanoic acid is a carboxylic acid with the chemical formula CH3CH2CH2COOH. It is a colorless liquid that has an unpleasant, rancid odor. This compound is used in the manufacturing of perfumes and as a food additive to impart an odor and flavor. 2-Ethyl-3-hydroxybutanoic acid is also used in the production of acrylic esters and amides, which are used in textile fibers, plastics, and rubber.

2-Chloro-4-nitrobenzoyl Chloride is a nitro derivative of 2-chloro-4-nitrophenol. It is used as an oral anti-cancer drug and to synthesize drugs, such as diuretics. 2CNBCl has been shown to have diuretic effects in rats and rabbits. It also inhibits the synthesis of nitric oxide by binding to vasopressin receptors and desulfurises the structural isomer of 4-(chloromethyl) benzene. 2CNBCl has been shown to inhibit the growth of cervical cancer cells, which may be due to its ability to activate apoptotic signaling pathways in these cells by binding with the vasopressin receptor.

Versatile small molecule scaffold

Versatile small molecule scaffold

3-Bromo-2,3-dihydro-4H-chromen-4-one is a borohydride reduction and molecular modeling study of an analog of the natural product. The 14α-demethylase enzyme catalyzes the conversion of 3β,14α-dihydroxyandrostane to 3β,14β-dihydroxyandrostane. This enzyme has stereoselective activity in the synthesis of androgens from progesterone. The hydrogen bond interactions between the active site residues and solvent molecules are important for the enzymatic activity.

Versatile small molecule scaffold

4-(2-Hydroxyethyl)piperazine, N1-BOC protected

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

1-(3,4-Dichlorobenzyl)-1,6-dihydro-6-oxopyridine-3-carboxaldehyde

Ethyl 4,5,6,7-tetrahydrothieno[2,3-c]pyridine-2-carboxylate

Versatile small molecule scaffold

2-Chloro-4-(piperidin-4-yloxy)benzonitrile hydrochloride

Versatile small molecule scaffold

Versatile small molecule scaffold

4-Chloro-2-(morpholin-4-yl)-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidine, N7-BOC protected

Versatile small molecule scaffold

Versatile small molecule scaffold

5-Methyl-1H-pyrrole-2-carbaldehyde

Versatile small molecule scaffold

Versatile small molecule scaffold

2,4-Dimethoxypyrimidine

Versatile small molecule scaffold

Versatile small molecule scaffold

4-Bromo-1-ethyl-3-(trifluoromethyl)-1H-pyrazole

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Methyl 6-chloro-1-benzofuran-2-carboxylate

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

Versatile small molecule scaffold

4-Bromo-2-methyl-2H-indazole

N-Benzyl-4-methylbenzamide is an organic compound that can be synthesized from benzyl chloride and 4-methylbenzoic acid. It has been used as a palladium catalyst in the cross-coupling reaction between nitriles and diboron reagents, yielding high yields of benzylic products. The presence of halides or halogenated compounds in this reaction leads to the formation of functionalities such as vinyl, acetate, and carboxylic acids. N-Benzyl-4-methylbenzamide also has been used for the synthesis of nitriles from halides or halogenated compounds. This reaction is catalyzed by palladium, forming a cross-coupling reaction.

Versatile small molecule scaffold

Versatile small molecule scaffold

4-Cyano-N,N-dimethylbenzamide is a versatile compound that has multiple applications. It can be used as an intermediate in the production of various chemicals, such as acaricides and phosphonic acid derivatives. Additionally, it has emulsification properties, making it useful in the formulation of certain products. This compound also exhibits antibiotic activity, making it potentially valuable in the development of new antimicrobial agents. Furthermore, its bioavailability and ability to interact with polymers suggest potential applications in drug delivery systems. In the field of research, 4-Cyano-N,N-dimethylbenzamide is commonly used as a reagent or reference standard for analytical purposes. Its high purity and stability make it a reliable choice for laboratory experiments. Overall, 4-Cyano-N,N-dimethylbenzamide is a multi-functional compound with diverse applications across various industries. Its unique characteristics make it a valuable asset in chemical synthesis, pharmaceutical research, and other scientific endeavors.

Versatile small molecule scaffold

Versatile small molecule scaffold