9-(3,5-difluorophenyl)-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
9-(3,5-difluorophenyl)-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
9-(3,5-difluorophenyl)-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | Y020-7581 |
| Compound Name: | 9-(3,5-difluorophenyl)-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 370.28 |
| Molecular Formula: | C16 H11 F5 N4 O |
| Smiles: | C1CC2=C(C(c3cc(cc(c3)F)F)n3c(N2)nc(C(F)(F)F)n3)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4592 |
| logD: | 0.054 |
| logSw: | -3.7816 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.616 |
| InChI Key: | KWJRFJBYVQUZCR-ZDUSSCGKSA-N |