Vitas-M small molecule compound
4-(4-chlorophenyl)-2-[5-(4-methylpiperazin-1-yl)-2-nitrophenyl]phthalazin-1(2H)-one
Catalog ID
STK172371
SMILES CN1CCN(CC1)c1ccc(c(c1)n1nc(c2ccc(cc2)Cl)c2c(c1=O)cccc2)[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 C25H22ClN5O3 MW 475.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN5O3/c1-28-12-14-29(15-13-28)19-10-11-22(31(33)34)23(16-19)30-25(32)21-5-3-2-4-20(21)24(27-30)17-6-8-18(26)9-7-17/h2-11,16H,12-15H2,1H3InChIKey
AQYLZFAAMVSOIX-UHFFFAOYSA-NSynonyms
4(4CHLOROPHENYL)2(5(4METHYLPIPERAZIN1YL)2NITROPHENYL)PHTHALAZIN1(2H)ONE
4(4CHLOROPHENYL)2(5(4METHYLPIPERAZIN1YL)2NITROPHENYL)PHTHALAZIN1ONE
CN1CCN(CC1)c1ccc(c(c1)n1nc(c2ccc(cc2)Cl)c2c(c1=O)cccc2)(N+)(=O)(O)
CN1CCN(CC1)C2=CC(=C(C=C2)(N+)(=O)(O))N3C(=O)C4=CC=CC=C4C(=N3)C5=CC=C(C=C5)Cl
InChI=1SC25H22ClN5O3c128121429(151328)19101122(31(33)34)23(1619)3025(32)21532420(21)24(2730)176818(26)9717h21116H1215H21H3
MFCD04077927
ZINC000009891971
ZINC9891971
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