Vitas-M small molecule compound
4-(4-chlorophenyl)-2-{5-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]-2-nitrophenyl}phthalazin-1(2H)-one
Catalog ID
STK154760
SMILES Clc1ccc(cc1)c1nn(c(=O)c2c1cccc2)c1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)C(C)(C)C
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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 C29H28ClN5O4 MW 546.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28ClN5O4/c1-29(2,3)28(37)33-16-14-32(15-17-33)21-12-13-24(35(38)39)25(18-21)34-27(36)23-7-5-4-6-22(23)26(31-34)19-8-10-20(30)11-9-19/h4-13,18H,14-17H2,1-3H3InChIKey
FDDRGFKLRDIZQJ-UHFFFAOYSA-NSynonyms
593237-84-44(4chlorophenyl)2(2nitro5(4pivaloylpiperazin1yl)phenyl)phthalazin1(2H)one
4(4CHLOROPHENYL)2(5(4(22DIMETHYLPROPANOYL)PIPERAZIN1YL)2NITROPHENYL)PHTHALAZIN1(2H)ONE
4(4CHLOROPHENYL)2(5(4(22DIMETHYLPROPANOYL)PIPERAZIN1YL)2NITROPHENYL)PHTHALAZIN1ONE
593237844
CC(C)(C)C(=O)N1CCN(CC1)C2=CC(=C(C=C2)(N+)(=O)(O))N3C(=O)C4=CC=CC=C4C(=N3)C5=CC=C(C=C5)Cl
Clc1ccc(cc1)c1nn(c(=O)c2c1cccc2)c1cc(ccc1(N+)(=O)(O))N1CCN(CC1)C(=O)C(C)(C)C
InChI=1SC29H28ClN5O4c129(23)28(37)33161432(151733)21121324(35(38)39)25(1821)3427(36)23754622(23)26(3134)1981020(30)11919h41318H1417H213H3
MFCD03694582
ZINC000059587035
ZINC59587035
Check stock
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Check stock on Vitas-MAvailable files
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