2-{[(4-bromophenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
2-{[(4-bromophenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
2-{[(4-bromophenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | 8018-7587 |
| Compound Name: | 2-{[(4-bromophenyl)methyl]sulfanyl}-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 349.25 |
| Molecular Formula: | C14 H13 Br N4 S |
| Smiles: | Cc1cc(C)n2c(n1)nc(n2)SCc1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.1896 |
| logD: | 3.1895 |
| logSw: | -2.9666 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.28 |
| InChI Key: | IMENXWDSGUALQL-UHFFFAOYSA-N |