N-[9-(3,4-dimethoxyanilino)-5,6,7,8-tetrahydroacridin-2-yl]-4-fluoro-3-nitrobenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[9-(3,4-dimethoxyanilino)-5,6,7,8-tetrahydroacridin-2-yl]-4-fluoro-3-nitrobenzamide--hydrogen chloride (1/1)
N-[9-(3,4-dimethoxyanilino)-5,6,7,8-tetrahydroacridin-2-yl]-4-fluoro-3-nitrobenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | C066-3690 |
| Compound Name: | N-[9-(3,4-dimethoxyanilino)-5,6,7,8-tetrahydroacridin-2-yl]-4-fluoro-3-nitrobenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 552.99 |
| Molecular Formula: | C28 H25 F N4 O5 |
| Salt: | HCl |
| Smiles: | COc1ccc(cc1OC)Nc1c2CCCCc2nc2ccc(cc12)NC(c1ccc(c(c1)[N+]([O-])=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3631 |
| logD: | 4.348 |
| logSw: | -5.5423 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.94 |
| InChI Key: | LVTHLXMVQXUYDT-UHFFFAOYSA-N |