7-(azepan-1-yl)-2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
7-(azepan-1-yl)-2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
7-(azepan-1-yl)-2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | D245-0601 |
| Compound Name: | 7-(azepan-1-yl)-2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 355.87 |
| Molecular Formula: | C19 H22 Cl N5 |
| Smiles: | Cc1cc(N2CCCCCC2)n2c(n1)nc(Cc1ccc(cc1)[Cl])n2 |
| Stereo: | ACHIRAL |
| logP: | 4.6432 |
| logD: | 4.5723 |
| logSw: | -4.7524 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 34.439 |
| InChI Key: | YXKJCYWXFFMKQZ-UHFFFAOYSA-N |