2-({6-[(2-chloro-4-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(2-ethylphenyl)acetamide
Chemical Structure Depiction of
2-({6-[(2-chloro-4-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(2-ethylphenyl)acetamide
2-({6-[(2-chloro-4-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(2-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | C121-0675 |
| Compound Name: | 2-({6-[(2-chloro-4-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(2-ethylphenyl)acetamide |
| Molecular Weight: | 483.99 |
| Molecular Formula: | C24 H23 Cl F N5 O S |
| Smiles: | CCc1ccccc1NC(CSc1nc2nc(C)c(Cc3ccc(cc3[Cl])F)c(C)n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4758 |
| logD: | 5.4758 |
| logSw: | -5.8675 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.006 |
| InChI Key: | QJNPYMOIOXMNQU-UHFFFAOYSA-N |