2-({6-[(2-chloro-6-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
Chemical Structure Depiction of
2-({6-[(2-chloro-6-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
2-({6-[(2-chloro-6-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
Compound characteristics
| Compound ID: | K784-8728 |
| Compound Name: | 2-({6-[(2-chloro-6-fluorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide |
| Molecular Weight: | 510.03 |
| Molecular Formula: | C26 H25 Cl F N5 O S |
| Smiles: | Cc1c(Cc2c(cccc2[Cl])F)c(C)n2c(n1)nc(n2)SCC(NC1CCCc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3246 |
| logD: | 5.3245 |
| logSw: | -5.7339 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.87 |
| InChI Key: | PEKNIGAWAONGBM-QHCPKHFHSA-N |