5-butyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Chemical Structure Depiction of
5-butyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
5-butyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indole-3-thiol
Compound characteristics
| Compound ID: | 6927-0948 |
| Compound Name: | 5-butyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indole-3-thiol |
| Molecular Weight: | 276.33 |
| Molecular Formula: | C13 H13 F N4 S |
| Smiles: | CCCCn1c2ccc(cc2c2c1nc(nn2)S)F |
| Stereo: | ACHIRAL |
| logP: | 3.2966 |
| logD: | 2.0716 |
| logSw: | -3.2646 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.105 |
| InChI Key: | SNLHCAFBLZGJIL-UHFFFAOYSA-N |