5,7-dimethyl-3-(octylsulfanyl)[1,2,4]triazolo[4,3-a]pyrimidine
Chemical Structure Depiction of
5,7-dimethyl-3-(octylsulfanyl)[1,2,4]triazolo[4,3-a]pyrimidine
5,7-dimethyl-3-(octylsulfanyl)[1,2,4]triazolo[4,3-a]pyrimidine
Compound characteristics
| Compound ID: | 6770-0033 |
| Compound Name: | 5,7-dimethyl-3-(octylsulfanyl)[1,2,4]triazolo[4,3-a]pyrimidine |
| Molecular Weight: | 292.44 |
| Molecular Formula: | C15 H24 N4 S |
| Smiles: | CCCCCCCCSc1nnc2nc(C)cc(C)n12 |
| Stereo: | ACHIRAL |
| logP: | 4.5738 |
| logD: | 4.5738 |
| logSw: | -4.3865 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.925 |
| InChI Key: | JEJSDRKEHLTGCX-UHFFFAOYSA-N |