Vitas-M small molecule compound

5-(4-chlorophenyl)-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one

Catalog ID
STK806530
SMILES Clc1ccc(cc1)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 C25H22ClNO MW 387.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClNO/c1-25(2)13-19-22-18-6-4-3-5-15(18)9-12-20(22)27-24(23(19)21(28)14-25)16-7-10-17(26)11-8-16/h3-12,24,27H,13-14H2,1-2H3
InChIKey
BUNDVYAZXGGGAU-UHFFFAOYSA-N
Synonyms
22949-37-7
22949377
5(4chlorophenyl)22dimethyl1356tetrahydrobenzo(a)phenanthridin4one
5(4chlorophenyl)22dimethyl2356tetrahydrobenzo(a)phenanthridin4(1H)one
CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC=C(C=C5)Cl)C(=O)C1)C
InChI=1SC25H22ClNOc125(2)13192218643515(18)91220(22)2724(23(19)21(28)1425)1671017(26)11816h3122427H1314H212H3
MFCD00348783
ZINC000002305920
ZINC000002305921

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.