Vitas-M small molecule compound

7-{4-[(3-chlorophenyl)carbonyl]piperazin-1-yl}-1-cyclopropyl-6-fluoro-N-octyl-4-oxo-1,4-dihydroquinoline-3-carboxamide

Catalog ID
STK530038
SMILES CCCCCCCCNC(=O)c1cn(C2CC2)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1cccc(c1)Cl)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 C32H38ClFN4O3 MW 581.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H38ClFN4O3/c1-2-3-4-5-6-7-13-35-31(40)26-21-38(24-11-12-24)28-20-29(27(34)19-25(28)30(26)39)36-14-16-37(17-15-36)32(41)22-9-8-10-23(33)18-22/h8-10,18-21,24H,2-7,11-17H2,1H3,(H,35,40)
InChIKey
HUAHFKNYYQCMDI-UHFFFAOYSA-N
Synonyms

7(4((3chlorophenyl)carbonyl)piperazin1yl)1cyclopropyl6fluoroNoctyl4oxo14dihydroquinoline3carboxamide
7(4(3chlorobenzoyl)piperazin1yl)1cyclopropyl6fluoroNoctyl4oxo14dihydroquinoline3carboxamide
7(4(3CHLOROBENZOYL)PIPERAZIN1YL)1CYCLOPROPYL6FLUORONOCTYL4OXOQUINOLINE3CARBOXAMIDE
CCCCCCCCNC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Cl)C5CC5
InChI=1SC32H38ClFN4O3c1234567133531(40)262138(24111224)282029(27(34)1925(28)30(26)39)36141637(171536)32(41)22981023(33)1822h810182124H271117H21H3(H3540)
MFCD01856408
ZINC000102407338
ZINC102407338

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Available files

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