N-{rel-(1R,4R,6S)-2-[(2-chloro-6-fluorophenyl)acetyl]-2-azabicyclo[2.2.1]heptan-6-yl}benzamide
Chemical Structure Depiction of
N-{rel-(1R,4R,6S)-2-[(2-chloro-6-fluorophenyl)acetyl]-2-azabicyclo[2.2.1]heptan-6-yl}benzamide
N-{rel-(1R,4R,6S)-2-[(2-chloro-6-fluorophenyl)acetyl]-2-azabicyclo[2.2.1]heptan-6-yl}benzamide
Compound characteristics
| Compound ID: | S032-0965 |
| Compound Name: | N-{rel-(1R,4R,6S)-2-[(2-chloro-6-fluorophenyl)acetyl]-2-azabicyclo[2.2.1]heptan-6-yl}benzamide |
| Molecular Weight: | 386.85 |
| Molecular Formula: | C21 H20 Cl F N2 O2 |
| Smiles: | C(C(N1C[C@@H]2C[C@@H]([C@H]1C2)NC(c1ccccc1)=O)=O)c1c(cccc1[Cl])F |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.5731 |
| logD: | 3.5731 |
| logSw: | -3.993 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.571 |
| InChI Key: | XDCCWMYUBFKAQL-BKTGTZMESA-N |