Vitas-M small molecule compound
2-[5-(4-acetylpiperazin-1-yl)-2-nitrophenyl]-4-(4-chlorophenyl)phthalazin-1(2H)-one
Catalog ID
STK157811
SMILES Clc1ccc(cc1)c1nn(c(=O)c2c1cccc2)c1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)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 C26H22ClN5O4 MW 503.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN5O4/c1-17(33)29-12-14-30(15-13-29)20-10-11-23(32(35)36)24(16-20)31-26(34)22-5-3-2-4-21(22)25(28-31)18-6-8-19(27)9-7-18/h2-11,16H,12-15H2,1H3InChIKey
KGRVIGHKCXDUJF-UHFFFAOYSA-NSynonyms
591736-88-82(5(4ACETYLPIPERAZIN1YL)2NITROPHENYL)4(4CHLOROPHENYL)PHTHALAZIN1(2H)ONE
2(5(4ACETYLPIPERAZIN1YL)2NITROPHENYL)4(4CHLOROPHENYL)PHTHALAZIN1ONE
591736888
CC(=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
InChI=1SC26H22ClN5O4c117(33)29121430(151329)20101123(32(35)36)24(1620)3126(34)22532421(22)25(2831)186819(27)9718h21116H1215H21H3
MFCD03694510
ZINC000009009021
ZINC09009021
ZINC9009021
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