N-benzyl-2-{[5,7-dimethyl-6-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-benzyl-2-{[5,7-dimethyl-6-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl}acetamide
N-benzyl-2-{[5,7-dimethyl-6-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | K784-7588 |
| Compound Name: | N-benzyl-2-{[5,7-dimethyl-6-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 367.47 |
| Molecular Formula: | C19 H21 N5 O S |
| Smiles: | Cc1c(CC=C)c(C)n2c(n1)nc(n2)SCC(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7853 |
| logD: | 2.7853 |
| logSw: | -3.1714 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.298 |
| InChI Key: | DSSUXPJZUJRERC-UHFFFAOYSA-N |