2-{[5,7-dimethyl-6-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl}-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-{[5,7-dimethyl-6-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl}-N-[(4-methylphenyl)methyl]acetamide
2-{[5,7-dimethyl-6-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl}-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | K784-7750 |
| Compound Name: | 2-{[5,7-dimethyl-6-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl}-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 381.5 |
| Molecular Formula: | C20 H23 N5 O S |
| Smiles: | Cc1ccc(CNC(CSc2nc3nc(C)c(CC=C)c(C)n3n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2087 |
| logD: | 3.2087 |
| logSw: | -3.2788 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.298 |
| InChI Key: | DCIAPGJNXUAQQX-UHFFFAOYSA-N |