Vitas-M small molecule compound
5-(5-bromo-2-hydroxy-3-nitrophenyl)-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Catalog ID
STK674457
SMILES Brc1cc(C2Nc3ccc4c(c3C3=C2C(=O)CC(C3)(C)C)cccc4)c(c(c1)[N+](=O)[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 C25H21BrN2O4 MW 493.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21BrN2O4/c1-25(2)11-17-21-15-6-4-3-5-13(15)7-8-18(21)27-23(22(17)20(29)12-25)16-9-14(26)10-19(24(16)30)28(31)32/h3-10,23,27,30H,11-12H2,1-2H3InChIKey
FMZMLWHVRKHFEL-UHFFFAOYSA-NSynonyms
312632-80-7312632807
5(5bromo2hydroxy3nitrophenyl)22dimethyl1356tetrahydrobenzo(a)phenanthridin4one
5(5bromo2hydroxy3nitrophenyl)22dimethyl2356tetrahydrobenzo(a)phenanthridin4(1H)one
Brc1cc(C2Nc3ccc4c(c3C3=C2C(=O)CC(C3)(C)C)cccc4)c(c(c1)(N+)(=O)(O))O
CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC(=CC(=C5O)(N+)(=O)(O))Br)C(=O)C1)C
InChI=1SC25H21BrN2O4c125(2)11172115643513(15)7818(21)2723(22(17)20(29)1225)16914(26)1019(24(16)30)28(31)32h310232730H1112H212H3
MFCD00836097
ZINC000036024614
ZINC000036024616
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