2-({6-[(3-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(4-ethoxyphenyl)acetamide
Chemical Structure Depiction of
2-({6-[(3-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(4-ethoxyphenyl)acetamide
2-({6-[(3-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(4-ethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C121-0352 |
| Compound Name: | 2-({6-[(3-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(4-ethoxyphenyl)acetamide |
| Molecular Weight: | 482 |
| Molecular Formula: | C24 H24 Cl N5 O2 S |
| Smiles: | CCOc1ccc(cc1)NC(CSc1nc2nc(C)c(Cc3cccc(c3)[Cl])c(C)n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1171 |
| logD: | 5.1171 |
| logSw: | -5.4097 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.828 |
| InChI Key: | PSXMBFGNMPRGBR-UHFFFAOYSA-N |