Vitas-M small molecule compound

7-{4-[(3-chlorophenyl)carbonyl]piperazin-1-yl}-1-cyclopropyl-6-fluoro-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide

Catalog ID
STK541087
SMILES Clc1cccc(c1)C(=O)N1CCN(CC1)c1cc2n(cc(c(=O)c2cc1F)C(=O)NCc1ccccn1)C1CC1

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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 C30H27ClFN5O3 MW 560.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27ClFN5O3/c31-20-5-3-4-19(14-20)30(40)36-12-10-35(11-13-36)27-16-26-23(15-25(27)32)28(38)24(18-37(26)22-7-8-22)29(39)34-17-21-6-1-2-9-33-21/h1-6,9,14-16,18,22H,7-8,10-13,17H2,(H,34,39)
InChIKey
JRDQRCCXJUYCLK-UHFFFAOYSA-N
Synonyms

(7(4((3CHLOROPHENYL)CARBONYL)PIPERAZINYL)1CYCLOPROPYL6FLUORO4OXO(3HYDROQUINOLYL))N(2PYRIDYLMETHYL)CARBOXAMIDE
7(4((3chlorophenyl)carbonyl)piperazin1yl)1cyclopropyl6fluoro4oxoN(pyridin2ylmethyl)14dihydroquinoline3carboxamide
7(4(3chlorobenzoyl)piperazin1yl)1cyclopropyl6fluoro4oxoN(pyridin2ylmethyl)14dihydroquinoline3carboxamide
7(4(3CHLOROBENZOYL)PIPERAZIN1YL)1CYCLOPROPYL6FLUORO4OXON(PYRIDIN2YLMETHYL)QUINOLINE3CARBOXAMIDE
C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C(=O)C5=CC(=CC=C5)Cl)F)C(=O)NCC6=CC=CC=N6
InChI=1SC30H27ClFN5O3c312053419(1420)30(40)36121035(111336)27162623(1525(27)32)28(38)24(1837(26)227822)29(39)34172161293321h16914161822H78101317H2(H3439)
MFCD01880766
ZINC000000859995
ZINC00859995
ZINC859995

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Available files

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