N-{rel-(1R,5S)-8-[(4-bromophenyl)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}pyridine-4-carboxamide
Chemical Structure Depiction of
N-{rel-(1R,5S)-8-[(4-bromophenyl)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}pyridine-4-carboxamide
N-{rel-(1R,5S)-8-[(4-bromophenyl)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}pyridine-4-carboxamide
Compound characteristics
| Compound ID: | T651-0760 |
| Compound Name: | N-{rel-(1R,5S)-8-[(4-bromophenyl)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}pyridine-4-carboxamide |
| Molecular Weight: | 428.33 |
| Molecular Formula: | C21 H22 Br N3 O2 |
| Smiles: | C(C(N1[C@H]2CC[C@@H]1CC(C2)NC(c1ccncc1)=O)=O)c1ccc(cc1)[Br] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.0161 |
| logD: | 2.0157 |
| logSw: | -1.9353 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.606 |
| InChI Key: | SHUKPLHFYFLHAN-YQQQUEKLSA-N |