5-amino-3-{[(1-phenyl-1H-tetrazol-5-yl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrimidin-7-ol
Chemical Structure Depiction of
5-amino-3-{[(1-phenyl-1H-tetrazol-5-yl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrimidin-7-ol
5-amino-3-{[(1-phenyl-1H-tetrazol-5-yl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrimidin-7-ol
Compound characteristics
| Compound ID: | 6404-0192 |
| Compound Name: | 5-amino-3-{[(1-phenyl-1H-tetrazol-5-yl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrimidin-7-ol |
| Molecular Weight: | 341.35 |
| Molecular Formula: | C13 H11 N9 O S |
| Smiles: | C(c1nnnn1c1ccccc1)Sc1nnc2nc(cc(N)n12)O |
| Stereo: | ACHIRAL |
| logP: | 0.3994 |
| logD: | 0.1836 |
| logSw: | -1.247 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 109.383 |
| InChI Key: | CTSDWSGIKBIIBN-UHFFFAOYSA-N |