Vitas-M small molecule compound
5-(3-bromo-4,5-dimethoxyphenyl)-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Catalog ID
STK756533
SMILES COc1c(Br)cc(cc1OC)C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccc3
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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 C27H26BrNO3 MW 492.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26BrNO3/c1-27(2)13-18-23-17-8-6-5-7-15(17)9-10-20(23)29-25(24(18)21(30)14-27)16-11-19(28)26(32-4)22(12-16)31-3/h5-12,25,29H,13-14H2,1-4H3InChIKey
CNSIJFUCKOFUEZ-UHFFFAOYSA-NSynonyms
5(3bromo45dimethoxyphenyl)22dimethyl1356tetrahydrobenzo(a)phenanthridin4one
5(3bromo45dimethoxyphenyl)22dimethyl2356tetrahydrobenzo(a)phenanthridin4(1H)one
CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC(=C(C(=C5)Br)OC)OC)C(=O)C1)C
InChI=1SC27H26BrNO3c127(2)13182317865715(17)91020(23)2925(24(18)21(30)1427)161119(28)26(324)22(1216)313h5122529H1314H214H3
MFCD01036035
ZINC000002188280
ZINC000002188281
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