N-{rel-(1R,5S)-8-[(3,4-dimethoxyphenyl)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}-4-fluorobenzamide
Chemical Structure Depiction of
N-{rel-(1R,5S)-8-[(3,4-dimethoxyphenyl)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}-4-fluorobenzamide
N-{rel-(1R,5S)-8-[(3,4-dimethoxyphenyl)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}-4-fluorobenzamide
Compound characteristics
| Compound ID: | T651-0046 |
| Compound Name: | N-{rel-(1R,5S)-8-[(3,4-dimethoxyphenyl)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}-4-fluorobenzamide |
| Molecular Weight: | 426.49 |
| Molecular Formula: | C24 H27 F N2 O4 |
| Smiles: | COc1ccc(CC(N2[C@H]3CC[C@@H]2CC(C3)NC(c2ccc(cc2)F)=O)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.0789 |
| logD: | 2.0789 |
| logSw: | -2.7919 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.439 |
| InChI Key: | RFZQYAHRQQVBCQ-PMACEKPBSA-N |