Vitas-M small molecule compound
[2-(1,3-benzodioxol-5-yl)quinolin-4-yl][4-(2-fluorophenyl)piperazin-1-yl]methanone
Catalog ID
STK433086
SMILES O=C(c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2)N1CCN(CC1)c1ccccc1F
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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 C27H22FN3O3 MW 455.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22FN3O3/c28-21-6-2-4-8-24(21)30-11-13-31(14-12-30)27(32)20-16-23(29-22-7-3-1-5-19(20)22)18-9-10-25-26(15-18)34-17-33-25/h1-10,15-16H,11-14,17H2InChIKey
VBDPCBZPQBUUKZ-UHFFFAOYSA-NSynonyms
(2(13benzodioxol5yl)quinolin4yl)(4(2fluorophenyl)piperazin1yl)methanone
2(2HBENZO(34D)13DIOXOLEN5YL)(4QUINOLYL)4(2FLUOROPHENYL)PIPERAZINYLKETONE
C1CN(CCN1C2=CC=CC=C2F)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC6=C(C=C5)OCO6
InChI=1SC27H22FN3O3c2821624824(21)30111331(141230)27(32)201623(2922731519(20)22)189102526(1518)34173325h1101516H111417H2
MFCD03395090
ZINC000000696116
ZINC00696116
ZINC696116
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