5-benzyl-8-methyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Chemical Structure Depiction of
5-benzyl-8-methyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
5-benzyl-8-methyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Compound characteristics
| Compound ID: | 6927-0940 |
| Compound Name: | 5-benzyl-8-methyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol |
| Molecular Weight: | 306.39 |
| Molecular Formula: | C17 H14 N4 S |
| Smiles: | Cc1ccc2c(c1)c1c(nc(nn1)S)n2Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9745 |
| logD: | 2.7495 |
| logSw: | -4.1113 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.855 |
| InChI Key: | LXZGUUXGAONCOD-UHFFFAOYSA-N |