2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
Compound ID: | K784-4572 |
Compound Name: | 2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine |
Molecular Weight: | 298.41 |
Molecular Formula: | C16 H18 N4 S |
Smiles: | Cc1ccc(C)c(CSc2nc3nc(C)cc(C)n3n2)c1 |
Stereo: | ACHIRAL |
logP: | 3.8608 |
logD: | 3.8605 |
logSw: | -3.6769 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 29.28 |
InChI Key: | ZFNYAEGHLMFZPZ-UHFFFAOYSA-N |