6-methyl-3-{[(1-phenyl-1H-tetrazol-5-yl)methyl]sulfanyl}-1,2,4-triazin-5-ol
Chemical Structure Depiction of
6-methyl-3-{[(1-phenyl-1H-tetrazol-5-yl)methyl]sulfanyl}-1,2,4-triazin-5-ol
6-methyl-3-{[(1-phenyl-1H-tetrazol-5-yl)methyl]sulfanyl}-1,2,4-triazin-5-ol
Compound characteristics
| Compound ID: | 6404-0059 |
| Compound Name: | 6-methyl-3-{[(1-phenyl-1H-tetrazol-5-yl)methyl]sulfanyl}-1,2,4-triazin-5-ol |
| Molecular Weight: | 301.33 |
| Molecular Formula: | C12 H11 N7 O S |
| Smiles: | Cc1c(nc(nn1)SCc1nnnn1c1ccccc1)O |
| Stereo: | ACHIRAL |
| logP: | 0.6915 |
| logD: | 0.0468 |
| logSw: | -1.1295 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.241 |
| InChI Key: | XMYMGJRYGNAWOP-UHFFFAOYSA-N |