8-methyl-5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Chemical Structure Depiction of
8-methyl-5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
8-methyl-5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Compound characteristics
| Compound ID: | 6927-0941 |
| Compound Name: | 8-methyl-5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indole-3-thiol |
| Molecular Weight: | 320.41 |
| Molecular Formula: | C18 H16 N4 S |
| Smiles: | Cc1ccc2c(c1)c1c(nc(nn1)S)n2CCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1239 |
| logD: | 2.8989 |
| logSw: | -4.3079 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.833 |
| InChI Key: | IXPFPTIWZUNBFR-UHFFFAOYSA-N |