benzyl [(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
benzyl [(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]acetate
benzyl [(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 8018-7589 |
| Compound Name: | benzyl [(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]acetate |
| Molecular Weight: | 328.39 |
| Molecular Formula: | C16 H16 N4 O2 S |
| Smiles: | Cc1cc(C)n2c(n1)nc(n2)SCC(=O)OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5118 |
| logD: | 2.5114 |
| logSw: | -2.6951 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.814 |
| InChI Key: | FXNJKSQPYUPVTE-UHFFFAOYSA-N |