N-(2-{[(7-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)-3-methylbenzamide
Chemical Structure Depiction of
N-(2-{[(7-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)-3-methylbenzamide
N-(2-{[(7-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)-3-methylbenzamide
Compound characteristics
| Compound ID: | C301-8729 |
| Compound Name: | N-(2-{[(7-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)-3-methylbenzamide |
| Molecular Weight: | 391.45 |
| Molecular Formula: | C20 H17 N5 O2 S |
| Smiles: | Cc1cccc(c1)C(Nc1ccccc1SCc1cc(n2c(ncn2)n1)O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8653 |
| logD: | 0.0214 |
| logSw: | -3.2109 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.082 |
| InChI Key: | WAEOACFLMNNZGV-UHFFFAOYSA-N |