Vitas-M small molecule compound
2-(5-{4-[(3-bromophenyl)carbonyl]piperazin-1-yl}-2-nitrophenyl)-4-(4-methylphenyl)phthalazin-1(2H)-one
Catalog ID
STK171840
SMILES Cc1ccc(cc1)c1nn(c(=O)c2c1cccc2)c1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)c1cccc(c1)Br
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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 C32H26BrN5O4 MW 624.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H26BrN5O4/c1-21-9-11-22(12-10-21)30-26-7-2-3-8-27(26)32(40)37(34-30)29-20-25(13-14-28(29)38(41)42)35-15-17-36(18-16-35)31(39)23-5-4-6-24(33)19-23/h2-14,19-20H,15-18H2,1H3InChIKey
FEYZTBFYNWRYMB-UHFFFAOYSA-NSynonyms
2(5(4((3BROMOPHENYL)CARBONYL)PIPERAZIN1YL)2NITROPHENYL)4(4METHYLPHENYL)PHTHALAZIN1(2H)ONE
2(5(4(3BROMOBENZOYL)PIPERAZIN1YL)2NITROPHENYL)4(4METHYLPHENYL)PHTHALAZIN1ONE
CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C4=C(C=CC(=C4)N5CCN(CC5)C(=O)C6=CC(=CC=C6)Br)(N+)(=O)(O)
Cc1ccc(cc1)c1nn(c(=O)c2c1cccc2)c1cc(ccc1(N+)(=O)(O))N1CCN(CC1)C(=O)c1cccc(c1)Br
InChI=1SC32H26BrN5O4c12191122(121021)3026723827(26)32(40)37(3430)292025(131428(29)38(41)42)35151736(181635)31(39)2354624(33)1923h2141920H1518H21H3
MFCD04082389
ZINC000029491228
ZINC29491228
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