2-[(6-benzyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-(3-ethoxypropyl)acetamide
Chemical Structure Depiction of
2-[(6-benzyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-(3-ethoxypropyl)acetamide
2-[(6-benzyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-(3-ethoxypropyl)acetamide
Compound characteristics
| Compound ID: | C179-0927 |
| Compound Name: | 2-[(6-benzyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-(3-ethoxypropyl)acetamide |
| Molecular Weight: | 413.54 |
| Molecular Formula: | C21 H27 N5 O2 S |
| Smiles: | CCOCCCNC(CSc1nc2nc(C)c(Cc3ccccc3)c(C)n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5656 |
| logD: | 2.5656 |
| logSw: | -2.7203 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.117 |
| InChI Key: | VXKUIQDIPUBGDJ-UHFFFAOYSA-N |