Vitas-M small molecule compound

2-(2-methylphenyl)-N-(pentafluorophenyl)quinoline-4-carboxamide

Catalog ID
STK427846
SMILES O=C(c1cc(nc2c1cccc2)c1ccccc1C)Nc1c(F)c(F)c(c(c1F)F)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 C23H13F5N2O MW 428.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13F5N2O/c1-11-6-2-3-7-12(11)16-10-14(13-8-4-5-9-15(13)29-16)23(31)30-22-20(27)18(25)17(24)19(26)21(22)28/h2-10H,1H3,(H,30,31)
InChIKey
QOCNJNLPHJUOGK-UHFFFAOYSA-N
Synonyms

2(2methylphenyl)N(23456pentafluorophenyl)quinoline4carboxamide
2(2methylphenyl)N(pentafluorophenyl)quinoline4carboxamide
CC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(C(=C4F)F)F)F)F
InChI=1SC23H13F5N2Oc111623712(11)161014(13845915(13)2916)23(31)302220(27)18(25)17(24)19(26)21(22)28h210H1H3(H3031)
MFCD01344968
ZINC000002082062
ZINC02082062
ZINC2082062

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Available files

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