6-methyl-3-[(3-methylbutyl)sulfanyl]-1,2,4-triazin-5-ol
Chemical Structure Depiction of
6-methyl-3-[(3-methylbutyl)sulfanyl]-1,2,4-triazin-5-ol
6-methyl-3-[(3-methylbutyl)sulfanyl]-1,2,4-triazin-5-ol
Compound characteristics
| Compound ID: | 4065-0464 |
| Compound Name: | 6-methyl-3-[(3-methylbutyl)sulfanyl]-1,2,4-triazin-5-ol |
| Molecular Weight: | 213.3 |
| Molecular Formula: | C9 H15 N3 O S |
| Smiles: | CC(C)CCSc1nc(c(C)nn1)O |
| Stereo: | ACHIRAL |
| logP: | 1.6587 |
| logD: | 0.7776 |
| logSw: | -1.2322 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.196 |
| InChI Key: | LSPCLSHTUUTGJB-UHFFFAOYSA-N |