Vitas-M small molecule compound

3-nitro-1-phenyl-4-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}quinolin-2(1H)-one

Catalog ID
STK108787
SMILES [O-][N+](=O)c1c(N2CCN(CC2)C/C=C/c2ccccc2)c2ccccc2n(c1=O)c1ccccc1

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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 C28H26N4O3 MW 466.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O3/c33-28-27(32(34)35)26(24-15-7-8-16-25(24)31(28)23-13-5-2-6-14-23)30-20-18-29(19-21-30)17-9-12-22-10-3-1-4-11-22/h1-16H,17-21H2/b12-9+
InChIKey
SHEIURDAWMEWHQ-FMIVXFBMSA-N
Synonyms
384797-42-6
(E)4(4cinnamylpiperazin1yl)3nitro1phenylquinolin2(1H)one
(O)(N+)(=O)c1c(N2CCN(CC2)CC=Cc2ccccc2)c2ccccc2n(c1=O)c1ccccc1
384797426
3NITRO1PHENYL4(4((2E)3PHENYLPROP2EN1YL)PIPERAZIN1YL)12DIHYDROQUINOLIN2ONE
3NITRO1PHENYL4(4((2E)3PHENYLPROP2EN1YL)PIPERAZIN1YL)QUINOLIN2(1H)ONE
3NITRO1PHENYL4(4((E)3PHENYLPROP2ENYL)PIPERAZIN1YL)QUINOLIN2ONE
4(4((2E)3PHENYLPROP2ENYL)PIPERAZINYL)3NITRO1PHENYLHYDROQUINOLIN2ONE
C1CN(CCN1CC=CC2=CC=CC=C2)C3=C(C(=O)N(C4=CC=CC=C43)C5=CC=CC=C5)(N+)(=O)(O)
InChI=1SC28H26N4O3c332827(32(34)35)26(2415781625(24)31(28)23135261423)30201829(192130)1791222103141122h116H1721H2b129+
MFCD01613400
ZINC000054290477
ZINC54290477

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Available files

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