2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(thiophen-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(thiophen-2-yl)methyl]acetamide
2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(thiophen-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C179-0749 |
| Compound Name: | 2-({6-[(2-chlorophenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(thiophen-2-yl)methyl]acetamide |
| Molecular Weight: | 458 |
| Molecular Formula: | C21 H20 Cl N5 O S2 |
| Smiles: | Cc1c(Cc2ccccc2[Cl])c(C)n2c(n1)nc(n2)SCC(NCc1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3917 |
| logD: | 4.3916 |
| logSw: | -4.3673 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.045 |
| InChI Key: | FGDRSGNDCDTOSV-UHFFFAOYSA-N |