5-benzyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Chemical Structure Depiction of
5-benzyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
5-benzyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Compound characteristics
| Compound ID: | 6623-1391 |
| Compound Name: | 5-benzyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol |
| Molecular Weight: | 292.36 |
| Molecular Formula: | C16 H12 N4 S |
| Smiles: | C(c1ccccc1)n1c2ccccc2c2c1nc(nn2)S |
| Stereo: | ACHIRAL |
| logP: | 3.4047 |
| logD: | 2.1797 |
| logSw: | -3.3568 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.855 |
| InChI Key: | CMWAFGJNLNZSMR-UHFFFAOYSA-N |