Vitas-M small molecule compound
2-[5-(4-acetylpiperazin-1-yl)-2-nitrophenyl]-4-methylphthalazin-1(2H)-one
Catalog ID
STK154761
SMILES CC(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(C)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 C21H21N5O4 MW 407.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O4/c1-14-17-5-3-4-6-18(17)21(28)25(22-14)20-13-16(7-8-19(20)26(29)30)24-11-9-23(10-12-24)15(2)27/h3-8,13H,9-12H2,1-2H3InChIKey
NINCBHAFKIRAIA-UHFFFAOYSA-NSynonyms
593237-85-52(5(4ACETYLPIPERAZIN1YL)2NITROPHENYL)4METHYLPHTHALAZIN1(2H)ONE
2(5(4ACETYLPIPERAZIN1YL)2NITROPHENYL)4METHYLPHTHALAZIN1ONE
593237855
CC(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(C)c2c(c1=O)cccc2)(N+)(=O)(O)
CC1=NN(C(=O)C2=CC=CC=C12)C3=C(C=CC(=C3)N4CCN(CC4)C(=O)C)(N+)(=O)(O)
InChI=1SC21H21N5O4c11417534618(17)21(28)25(2214)201316(7819(20)26(29)30)2411923(101224)15(2)27h3813H912H212H3
MFCD03689186
ZINC000004687947
ZINC04687947
ZINC4687947
Check stock
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Check stock on Vitas-MAvailable files
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