5,8-diethyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Chemical Structure Depiction of
5,8-diethyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
5,8-diethyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Compound characteristics
| Compound ID: | 5818-0642 |
| Compound Name: | 5,8-diethyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol |
| Molecular Weight: | 258.34 |
| Molecular Formula: | C13 H14 N4 S |
| Smiles: | CCc1ccc2c(c1)c1c(nc(nn1)S)n2CC |
| Stereo: | ACHIRAL |
| logP: | 3.192 |
| logD: | 1.967 |
| logSw: | -3.0214 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.851 |
| InChI Key: | LINIQQGWMWSICD-UHFFFAOYSA-N |