9-fluoro-2-methyl-6-{2-[4-(trifluoromethyl)phenyl]ethyl}-1,2,3,4,5,6-hexahydroazepino[4,3-b]indole--hydrogen chloride (1/1)
Chemical Structure Depiction of
9-fluoro-2-methyl-6-{2-[4-(trifluoromethyl)phenyl]ethyl}-1,2,3,4,5,6-hexahydroazepino[4,3-b]indole--hydrogen chloride (1/1)
9-fluoro-2-methyl-6-{2-[4-(trifluoromethyl)phenyl]ethyl}-1,2,3,4,5,6-hexahydroazepino[4,3-b]indole--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | H025-0309C |
| Compound Name: | 9-fluoro-2-methyl-6-{2-[4-(trifluoromethyl)phenyl]ethyl}-1,2,3,4,5,6-hexahydroazepino[4,3-b]indole--hydrogen chloride (1/1) |
| Molecular Weight: | 426.88 |
| Molecular Formula: | C22 H22 F4 N2 |
| Salt: | HCl |
| Smiles: | CN1CCCc2c(C1)c1cc(ccc1n2CCc1ccc(cc1)C(F)(F)F)F |
| Stereo: | ACHIRAL |
| logP: | 5.2525 |
| logD: | 0.3444 |
| logSw: | -5.332 |
| Hydrogen bond acceptors count: | 1 |
| Polar surface area: | 5.0637 |
| InChI Key: | HPOCKVRELANFNY-UHFFFAOYSA-N |