N-tert-butyl-2-({6-[(3-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-tert-butyl-2-({6-[(3-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide
N-tert-butyl-2-({6-[(3-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | C121-0350 |
| Compound Name: | N-tert-butyl-2-({6-[(3-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 417.96 |
| Molecular Formula: | C20 H24 Cl N5 O S |
| Smiles: | Cc1c(Cc2cccc(c2)[Cl])c(C)n2c(n1)nc(n2)SCC(NC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1585 |
| logD: | 4.1585 |
| logSw: | -4.4189 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.122 |
| InChI Key: | AZHJWABZZUTAIJ-UHFFFAOYSA-N |