2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-cyclooctylacetamide
Chemical Structure Depiction of
2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-cyclooctylacetamide
2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-cyclooctylacetamide
Compound characteristics
| Compound ID: | C179-0730 |
| Compound Name: | 2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-cyclooctylacetamide |
| Molecular Weight: | 472.05 |
| Molecular Formula: | C24 H30 Cl N5 O S |
| Smiles: | Cc1c(Cc2ccccc2[Cl])c(C)n2c(n1)nc(n2)SCC(NC1CCCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6231 |
| logD: | 5.623 |
| logSw: | -5.7395 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.083 |
| InChI Key: | PLTKDRIFNKTPLW-UHFFFAOYSA-N |