4-methyl-N-(2-{[(7-oxo-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
4-methyl-N-(2-{[(7-oxo-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)benzamide
4-methyl-N-(2-{[(7-oxo-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | G647-3132 |
| Compound Name: | 4-methyl-N-(2-{[(7-oxo-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 391.45 |
| Molecular Formula: | C20 H17 N5 O2 S |
| Smiles: | Cc1ccc(cc1)C(Nc1ccccc1SCC1=CC(N2C(NC=N2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2713 |
| logD: | 2.2713 |
| logSw: | -2.6458 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.201 |
| InChI Key: | CHCOZSSODHENLJ-UHFFFAOYSA-N |