9-{4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazoline
Chemical Structure Depiction of
9-{4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazoline
9-{4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazoline
Compound characteristics
| Compound ID: | V011-5356 |
| Compound Name: | 9-{4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazoline |
| Molecular Weight: | 400.88 |
| Molecular Formula: | C20 H22 Cl F N6 |
| Salt: | not_available |
| Smiles: | C1CCC2C(C1)=C(N1CCN(CC1)Cc1c(cccc1[Cl])F)n1c(N=2)ncn1 |
| Stereo: | ACHIRAL |
| logP: | 3.375 |
| logD: | 3.3073 |
| logSw: | -3.5775 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 43.171 |
| InChI Key: | GPGIDBUENXRFJE-UHFFFAOYSA-N |