5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Chemical Structure Depiction of
5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Compound characteristics
| Compound ID: | 8009-7530 |
| Compound Name: | 5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indole-3-thiol |
| Molecular Weight: | 306.39 |
| Molecular Formula: | C17 H14 N4 S |
| Smiles: | C(Cn1c2ccccc2c2c1nc(nn2)S)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5542 |
| logD: | 2.3292 |
| logSw: | -3.5664 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.833 |
| InChI Key: | JZMKJONDRDUVGT-UHFFFAOYSA-N |