5-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D718-0295 |
| Compound Name: | 5-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 286.35 |
| Molecular Formula: | C14 H14 N4 O S |
| Smiles: | CC1=CC(n2c(N1)nc(n2)SCc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.425 |
| logD: | 1.8159 |
| logSw: | -2.8359 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.456 |
| InChI Key: | GNAPJGIFWQKUOA-UHFFFAOYSA-N |