2-[(6-benzyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-1-(morpholin-4-yl)ethan-1-one
Chemical Structure Depiction of
2-[(6-benzyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-1-(morpholin-4-yl)ethan-1-one
2-[(6-benzyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-1-(morpholin-4-yl)ethan-1-one
Compound characteristics
| Compound ID: | C179-1006 |
| Compound Name: | 2-[(6-benzyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-1-(morpholin-4-yl)ethan-1-one |
| Molecular Weight: | 397.5 |
| Molecular Formula: | C20 H23 N5 O2 S |
| Smiles: | Cc1c(Cc2ccccc2)c(C)n2c(n1)nc(n2)SCC(N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1513 |
| logD: | 2.1509 |
| logSw: | -2.3316 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.856 |
| InChI Key: | LPOCEWWJGVSZMS-UHFFFAOYSA-N |