5-benzyl-8-fluoro-3-{[2-(piperidin-1-yl)ethyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole
Chemical Structure Depiction of
5-benzyl-8-fluoro-3-{[2-(piperidin-1-yl)ethyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole
5-benzyl-8-fluoro-3-{[2-(piperidin-1-yl)ethyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole
Compound characteristics
| Compound ID: | 7745-1520 |
| Compound Name: | 5-benzyl-8-fluoro-3-{[2-(piperidin-1-yl)ethyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C23 H24 F N5 S |
| Smiles: | C1CCN(CC1)CCSc1nc2c(c3cc(ccc3n2Cc2ccccc2)F)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.6452 |
| logD: | 2.729 |
| logSw: | -4.585 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.689 |
| InChI Key: | MIDRMHOHJRORQG-UHFFFAOYSA-N |