5-benzyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Chemical Structure Depiction of
5-benzyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
5-benzyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Compound characteristics
| Compound ID: | 6927-0949 |
| Compound Name: | 5-benzyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indole-3-thiol |
| Molecular Weight: | 310.35 |
| Molecular Formula: | C16 H11 F N4 S |
| Smiles: | C(c1ccccc1)n1c2ccc(cc2c2c1nc(nn2)S)F |
| Stereo: | ACHIRAL |
| logP: | 3.5851 |
| logD: | 2.3601 |
| logSw: | -3.6892 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.855 |
| InChI Key: | LCSCMVAEXNEHAE-UHFFFAOYSA-N |