6-[(2,5-dimethylphenyl)methyl]-2-{[(3-fluorophenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
6-[(2,5-dimethylphenyl)methyl]-2-{[(3-fluorophenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
6-[(2,5-dimethylphenyl)methyl]-2-{[(3-fluorophenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | K784-6136 |
| Compound Name: | 6-[(2,5-dimethylphenyl)methyl]-2-{[(3-fluorophenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 406.52 |
| Molecular Formula: | C23 H23 F N4 S |
| Smiles: | Cc1ccc(C)c(Cc2c(C)nc3nc(nn3c2C)SCc2cccc(c2)F)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.9408 |
| logD: | 5.9407 |
| logSw: | -5.6878 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.5549 |
| InChI Key: | PSUMYPKWRWZLTE-UHFFFAOYSA-N |