1-(7-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethan-1-one
Chemical Structure Depiction of
1-(7-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethan-1-one
1-(7-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethan-1-one
Compound characteristics
| Compound ID: | Y020-2046 |
| Compound Name: | 1-(7-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethan-1-one |
| Molecular Weight: | 312.39 |
| Molecular Formula: | C16 H16 N4 O S |
| Smiles: | CC(c1cnc2nc(nn2c1C)SCc1ccccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.005 |
| logD: | 3.005 |
| logSw: | -3.0636 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.598 |
| InChI Key: | DETGMYCLNDRFAF-UHFFFAOYSA-N |