- 2 of 2 defined stereocentres
5-{[(1R,2S)-2-Aminocyclohexyl]amino}-7-[(3,5-dimethoxyphenyl)amino]-2-(3-hydroxyphenyl)[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide
O=C(c2c1nc(nn1c(nc2Nc3cc(OC)cc(OC)c3)N[C@@H]4CCCC[C@@H]4N)c5cccc(O)c5)N
InChI=1S/C26H30N8O4/c1-37-17-11-15(12-18(13-17)38-2)29-24-21(22(28)36)25-31-23(14-6-5-7-16(35)10-14)33-34(25)26(32-24)30-20-9-4-3-8-19(20)27/h5-7,10-13,19-20,29,35H,3-4,8-9,27H2,1-2H3,(H2,28,36)(H,30,32)/t19-,20+/m0/s1
JQVIBYQWWUOARA-VQTJNVASSA-N
CSID:8499774, http://www.chemspider.com/Chemical-Structure.8499774.html (accessed 18:12, Apr 19, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
Advertisement
Spotlight