6-(furan-2-yl)-9-phenyl-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
6-(furan-2-yl)-9-phenyl-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
6-(furan-2-yl)-9-phenyl-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | 7695-0305 |
| Compound Name: | 6-(furan-2-yl)-9-phenyl-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 400.36 |
| Molecular Formula: | C20 H15 F3 N4 O2 |
| Smiles: | C1C(CC(C2C(c3ccccc3)n3c(NC1=2)nc(C(F)(F)F)n3)=O)c1ccco1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1584 |
| logD: | 0.3033 |
| logSw: | -4.3133 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.923 |
| InChI Key: | BJKOCRSVLPCKDM-UHFFFAOYSA-N |