N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(furan-2-yl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine
Chemical Structure Depiction of
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(furan-2-yl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(furan-2-yl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine
Compound characteristics
| Compound ID: | G702-1738 |
| Compound Name: | N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(furan-2-yl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine |
| Molecular Weight: | 433.82 |
| Molecular Formula: | C20 H15 Cl F3 N5 O |
| Smiles: | C1CCC2C(C1)=C(Nc1ccc(c(c1)C(F)(F)F)[Cl])n1c(N=2)nc(c2ccco2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.5985 |
| logD: | 5.5884 |
| logSw: | -6.1396 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.471 |
| InChI Key: | VPIAFZXWYBFVFC-UHFFFAOYSA-N |