Vitas-M small molecule compound

2-(4-heptylphenyl)-2-oxoethyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate

Catalog ID
STK196166
SMILES CCCCCCCc1ccc(cc1)C(=O)COC(=O)c1cc(nc2c1cc(Br)cc2)c1ccc(cc1)Cl

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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 C31H29BrClNO3 MW 578.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29BrClNO3/c1-2-3-4-5-6-7-21-8-10-23(11-9-21)30(35)20-37-31(36)27-19-29(22-12-15-25(33)16-13-22)34-28-17-14-24(32)18-26(27)28/h8-19H,2-7,20H2,1H3
InChIKey
JQLMBEMTEVLVEG-UHFFFAOYSA-N
Synonyms
355429-31-1
(2(4HEPTYLPHENYL)2OXOETHYL)6BROMO2(4CHLOROPHENYL)QUINOLINE4CARBOXYLATE
2(4HEPTYLPHENYL)2OXOETHYL6BROMO2(4CHLOROPHENYL)QUINOLINE4CARBOXYLATE
355429311
CCCCCCCC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)Cl
InChI=1SC31H29BrClNO3c12345672181023(11921)30(35)203731(36)271929(22121525(33)161322)3428171424(32)1826(27)28h819H2720H21H3
MFCD02188518
ZINC000002578226
ZINC2578226

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Available files

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