Vitas-M small molecule compound
2-methyl-4-[3-nitro-4-(4-phenylpiperazin-1-yl)phenyl]phthalazin-1(2H)-one
Catalog ID
STK843855
SMILES O=c1n(C)nc(c2c1cccc2)c1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)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 C25H23N5O3 MW 441.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O3/c1-27-25(31)21-10-6-5-9-20(21)24(26-27)18-11-12-22(23(17-18)30(32)33)29-15-13-28(14-16-29)19-7-3-2-4-8-19/h2-12,17H,13-16H2,1H3InChIKey
YTURFRALSGOWRO-UHFFFAOYSA-NSynonyms
692262-95-62methyl4(3nitro4(4phenylpiperazin1yl)phenyl)phthalazin1(2H)one
2METHYL4(3NITRO4(4PHENYLPIPERAZIN1YL)PHENYL)PHTHALAZIN1ONE
692262956
CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC(=C(C=C3)N4CCN(CC4)C5=CC=CC=C5)(N+)(=O)(O)
InChI=1SC25H23N5O3c12725(31)211065920(21)24(2627)18111222(23(1718)30(32)33)29151328(141629)197324819h21217H1316H21H3
MFCD03680552
O=c1n(C)nc(c2c1cccc2)c1ccc(c(c1)(N+)(=O)(O))N1CCN(CC1)c1ccccc1
ZINC000004172280
ZINC04172280
ZINC4172280
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