Vitas-M small molecule compound
[2-(1,3-benzodioxol-5-yl)quinolin-4-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone
Catalog ID
STK433080
SMILES O=C(c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]
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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 C27H22N4O5 MW 482.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N4O5/c32-27(30-13-11-29(12-14-30)19-6-8-20(9-7-19)31(33)34)22-16-24(28-23-4-2-1-3-21(22)23)18-5-10-25-26(15-18)36-17-35-25/h1-10,15-16H,11-14,17H2InChIKey
HCHSJKPCEMBVHZ-UHFFFAOYSA-NSynonyms
(2(13benzodioxol5yl)quinolin4yl)(4(4nitrophenyl)piperazin1yl)methanone
2(13BENZODIOXOL5YL)4((4(4NITROPHENYL)1PIPERAZINYL)CARBONYL)QUINOLINE
2(2HBENZO(34D)13DIOXOLEN5YL)(4QUINOLYL)4(4NITROPHENYL)PIPERAZINYLKETONE
C1CN(CCN1C2=CC=C(C=C2)(N+)(=O)(O))C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC6=C(C=C5)OCO6
InChI=1SC27H22N4O5c3227(30131129(121430)196820(9719)31(33)34)221624(2823421321(22)23)185102526(1518)36173525h1101516H111417H2
MFCD03392547
O=C(c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
ZINC000008450974
ZINC08450974
ZINC8450974
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