N-benzyl-2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-methylacetamide
Chemical Structure Depiction of
N-benzyl-2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-methylacetamide
N-benzyl-2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-methylacetamide
Compound characteristics
| Compound ID: | C179-0775 |
| Compound Name: | N-benzyl-2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-methylacetamide |
| Molecular Weight: | 466 |
| Molecular Formula: | C24 H24 Cl N5 O S |
| Smiles: | Cc1c(Cc2ccccc2[Cl])c(C)n2c(n1)nc(n2)SCC(N(C)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.953 |
| logD: | 4.9527 |
| logSw: | -4.9233 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.45 |
| InChI Key: | DJHLMEADDRHTSN-UHFFFAOYSA-N |