7-(5-bromo-2-fluorophenyl)-5-(3-chloro-4-ethoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
7-(5-bromo-2-fluorophenyl)-5-(3-chloro-4-ethoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine
7-(5-bromo-2-fluorophenyl)-5-(3-chloro-4-ethoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | K832-4094 |
| Compound Name: | 7-(5-bromo-2-fluorophenyl)-5-(3-chloro-4-ethoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 451.72 |
| Molecular Formula: | C19 H17 Br Cl F N4 O |
| Smiles: | CCOc1ccc(cc1[Cl])C1CC(c2cc(ccc2F)[Br])n2c(N1)ncn2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1811 |
| logD: | 5.181 |
| logSw: | -5.9001 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.279 |
| InChI Key: | SQOISYUZZVNIAO-UHFFFAOYSA-N |