7-(azepan-1-yl)-2-benzyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
7-(azepan-1-yl)-2-benzyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
7-(azepan-1-yl)-2-benzyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | D245-0537 |
| Compound Name: | 7-(azepan-1-yl)-2-benzyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 321.42 |
| Molecular Formula: | C19 H23 N5 |
| Smiles: | Cc1cc(N2CCCCCC2)n2c(n1)nc(Cc1ccccc1)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.0485 |
| logD: | 3.9776 |
| logSw: | -4.0744 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 34.439 |
| InChI Key: | QUPJNCLTSRNSRY-UHFFFAOYSA-N |