3-(hexylsulfanyl)-5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidine
Chemical Structure Depiction of
3-(hexylsulfanyl)-5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidine
3-(hexylsulfanyl)-5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidine
Compound characteristics
| Compound ID: | 6770-0035 |
| Compound Name: | 3-(hexylsulfanyl)-5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidine |
| Molecular Weight: | 264.39 |
| Molecular Formula: | C13 H20 N4 S |
| Smiles: | CCCCCCSc1nnc2nc(C)cc(C)n12 |
| Stereo: | ACHIRAL |
| logP: | 3.582 |
| logD: | 3.582 |
| logSw: | -3.4474 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.925 |
| InChI Key: | UUEBYMUMJDSZBS-UHFFFAOYSA-N |