Vitas-M small molecule compound
1-[4-(2-fluorophenyl)piperazin-1-yl]-2-{[2,2,4-trimethyl-1-(phenylcarbonyl)-1,2-dihydroquinolin-6-yl]oxy}ethanone
Catalog ID
STL436295
SMILES O=C(N1CCN(CC1)c1ccccc1F)COc1ccc2c(c1)C(=CC(N2C(=O)c1ccccc1)(C)C)C
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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 C31H32FN3O3 MW 513.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32FN3O3/c1-22-20-31(2,3)35(30(37)23-9-5-4-6-10-23)27-14-13-24(19-25(22)27)38-21-29(36)34-17-15-33(16-18-34)28-12-8-7-11-26(28)32/h4-14,19-20H,15-18,21H2,1-3H3InChIKey
MXQVLMMIIBWZOO-UHFFFAOYSA-NSynonyms
1(4(2fluorophenyl)piperazin1yl)2((224trimethyl1(phenylcarbonyl)12dihydroquinolin6yl)oxy)ethanone
2(1benzoyl224trimethylquinolin6yl)oxy1(4(2fluorophenyl)piperazin1yl)ethanone
CC1=CC(N(C2=C1C=C(C=C2)OCC(=O)N3CCN(CC3)C4=CC=CC=C4F)C(=O)C5=CC=CC=C5)(C)C
InChI=1SC31H32FN3O3c1222031(23)35(30(37)2395461023)27141324(1925(22)27)382129(36)34171533(161834)2812871126(28)32h4141920H151821H213H3
MFCD30711937
ZINC000226075050
ZINC226075050
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