5-amino-3-(heptylsulfanyl)[1,2,4]triazolo[4,3-a]pyrimidin-7-ol
Chemical Structure Depiction of
5-amino-3-(heptylsulfanyl)[1,2,4]triazolo[4,3-a]pyrimidin-7-ol
5-amino-3-(heptylsulfanyl)[1,2,4]triazolo[4,3-a]pyrimidin-7-ol
Compound characteristics
| Compound ID: | 6143-0139 |
| Compound Name: | 5-amino-3-(heptylsulfanyl)[1,2,4]triazolo[4,3-a]pyrimidin-7-ol |
| Molecular Weight: | 281.38 |
| Molecular Formula: | C12 H19 N5 O S |
| Smiles: | CCCCCCCSc1nnc2nc(cc(N)n12)O |
| Stereo: | ACHIRAL |
| logP: | 2.984 |
| logD: | 2.7681 |
| logSw: | -2.8043 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.338 |
| InChI Key: | KXOQKDGKRHNGBV-UHFFFAOYSA-N |