N-(3-chloro-4-fluorophenyl)-2-(4-methylphenyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-(4-methylphenyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine
N-(3-chloro-4-fluorophenyl)-2-(4-methylphenyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine
Compound characteristics
| Compound ID: | G702-6146 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-(4-methylphenyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine |
| Molecular Weight: | 407.88 |
| Molecular Formula: | C22 H19 Cl F N5 |
| Smiles: | Cc1ccc(cc1)c1nc2N=C3CCCCC3=C(Nc3ccc(c(c3)[Cl])F)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 6.1954 |
| logD: | 6.1915 |
| logSw: | -6.282 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.893 |
| InChI Key: | CWDMMBZQYUIVDY-UHFFFAOYSA-N |