Vitas-M small molecule compound

N-cyclohexyl-1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxamide

Catalog ID
STK529986
SMILES CCn1cc(C(=O)NC2CCCCC2)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

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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 C23H31FN4O2 MW 414.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31FN4O2/c1-3-27-15-18(23(30)25-16-7-5-4-6-8-16)22(29)17-13-19(24)21(14-20(17)27)28-11-9-26(2)10-12-28/h13-16H,3-12H2,1-2H3,(H,25,30)
InChIKey
RUQYEBRGOBABHB-UHFFFAOYSA-N
Synonyms
371947-18-1
371947181
CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)NC4CCCCC4
InChI=1SC23H31FN4O2c13271518(23(30)25167546816)22(29)171319(24)21(1420(17)27)2811926(2)101228h1316H312H212H3(H2530)
MFCD01857719
Ncyclohexyl1ethyl6fluoro7(4methylpiperazin1yl)4oxo14dihydroquinoline3carboxamide
NCYCLOHEXYL1ETHYL6FLUORO7(4METHYLPIPERAZIN1YL)4OXOQUINOLINE3CARBOXAMIDE
ZINC000002269745
ZINC2269745

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Available files

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