Vitas-M small molecule compound
4-[4-(4-benzylpiperazin-1-yl)-3-nitrophenyl]-2-methylphthalazin-1(2H)-one
Catalog ID
STK238649
SMILES O=c1n(C)nc(c2c1cccc2)c1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)Cc1ccccc1
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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 C26H25N5O3 MW 455.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O3/c1-28-26(32)22-10-6-5-9-21(22)25(27-28)20-11-12-23(24(17-20)31(33)34)30-15-13-29(14-16-30)18-19-7-3-2-4-8-19/h2-12,17H,13-16,18H2,1H3InChIKey
SYNCGAAKCDNQJJ-UHFFFAOYSA-NSynonyms
587005-91-24(4(4benzylpiperazin1yl)3nitrophenyl)2methylphthalazin1(2H)one
4(4(4BENZYLPIPERAZIN1YL)3NITROPHENYL)2METHYLPHTHALAZIN1ONE
587005912
CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC(=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5)(N+)(=O)(O)
InChI=1SC26H25N5O3c12826(32)221065921(22)25(2728)20111223(24(1720)31(33)34)30151329(141630)18197324819h21217H131618H21H3
MFCD04033229
O=c1n(C)nc(c2c1cccc2)c1ccc(c(c1)(N+)(=O)(O))N1CCN(CC1)Cc1ccccc1
ZINC000055531327
ZINC55531327
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