6-(4-methoxyphenyl)-9-[4-(propan-2-yl)phenyl]-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
6-(4-methoxyphenyl)-9-[4-(propan-2-yl)phenyl]-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
6-(4-methoxyphenyl)-9-[4-(propan-2-yl)phenyl]-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | 7567-0312 |
| Compound Name: | 6-(4-methoxyphenyl)-9-[4-(propan-2-yl)phenyl]-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 482.5 |
| Molecular Formula: | C26 H25 F3 N4 O2 |
| Smiles: | CC(C)c1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(cc2)OC)Nc2nc(C(F)(F)F)nn12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.3566 |
| logD: | 2.367 |
| logSw: | -5.6278 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.888 |
| InChI Key: | JALIULDIYICLPU-UHFFFAOYSA-N |