Vitas-M small molecule compound

methyl 4-{[(4-hydroxy-2-oxo-1-propyl-1,2-dihydroquinolin-3-yl)carbonyl]amino}benzoate

Catalog ID
STK048628
SMILES CCCn1c(=O)c(C(=O)Nc2ccc(cc2)C(=O)OC)c(c2c1cccc2)O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C21H20N2O5 MW 380.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O5/c1-3-12-23-16-7-5-4-6-15(16)18(24)17(20(23)26)19(25)22-14-10-8-13(9-11-14)21(27)28-2/h4-11,24H,3,12H2,1-2H3,(H,22,25)
InChIKey
PAXLTEUGJSIXMT-UHFFFAOYSA-N
Synonyms
304879-10-5
304879105
CCCn1c(=O)c(C(=O)Nc2ccc(cc2)C(=O)OC)c(c2c1cccc2)O
CCCN1C2=CC=CC=C2C(=C(C1=O)C(=O)NC3=CC=C(C=C3)C(=O)OC)O
InChI=1SC21H20N2O5c13122316754615(16)18(24)17(20(23)26)19(25)221410813(91114)21(27)282h41124H312H212H3(H2225)
METHYL4(((4HYDROXY2OXO1PROPYL12DIHYDROQUINOLIN3YL)CARBONYL)AMINO)BENZOATE
METHYL4((2HYDROXY4OXO1PROPYLQUINOLINE3CARBONYL)AMINO)BENZOATE
methyl4((4hydroxy2oxo1propylquinoline3carbonyl)amino)benzoate
methyl4(4hydroxy2oxo1propyl12dihydroquinoline3carboxamido)benzoate
MFCD01046257
STK048628
ZINC000100543110
ZINC100543110

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.