Vitas-M small molecule compound

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

Catalog ID
STK995732
SMILES O=C1CC(C)(C)CC2=C1c1c(NC2c2cccnc2)ccc2c1cccc2

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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 C24H22N2O MW 354.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O/c1-24(2)12-18-22(20(27)13-24)21-17-8-4-3-6-15(17)9-10-19(21)26-23(18)16-7-5-11-25-14-16/h3-11,14,23,26H,12-13H2,1-2H3
InChIKey
IRXLOOHPFLBWHK-UHFFFAOYSA-N
Synonyms

33dimethyl5(pyridin3yl)3456tetrahydrobenzo(a)phenanthridin1(2H)one
33dimethyl5pyridin3yl2456tetrahydrobenzo(a)phenanthridin1one
CC1(CC2=C(C(=O)C1)C3=C(C=CC4=CC=CC=C43)NC2C5=CN=CC=C5)C
InChI=1SC24H22N2Oc124(2)121822(20(27)1324)2117843615(17)91019(21)2623(18)167511251416h311142326H1213H212H3
MFCD03017312
ZINC000001154755
ZINC000001154756

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Available files

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