6-methyl-3-[(2-phenylethyl)sulfanyl]-1,2,4-triazin-5-ol
Chemical Structure Depiction of
6-methyl-3-[(2-phenylethyl)sulfanyl]-1,2,4-triazin-5-ol
6-methyl-3-[(2-phenylethyl)sulfanyl]-1,2,4-triazin-5-ol
Compound characteristics
| Compound ID: | 8012-7827 |
| Compound Name: | 6-methyl-3-[(2-phenylethyl)sulfanyl]-1,2,4-triazin-5-ol |
| Molecular Weight: | 247.32 |
| Molecular Formula: | C12 H13 N3 O S |
| Smiles: | Cc1c(nc(nn1)SCCc1ccccc1)O |
| Stereo: | ACHIRAL |
| logP: | 1.9779 |
| logD: | 1.0968 |
| logSw: | -1.6632 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.924 |
| InChI Key: | BODKIUXYWMOLCS-UHFFFAOYSA-N |