N-{rel-(1R,5S)-8-[(4-chloro-2-methylphenoxy)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}pyridine-4-carboxamide
Chemical Structure Depiction of
N-{rel-(1R,5S)-8-[(4-chloro-2-methylphenoxy)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}pyridine-4-carboxamide
N-{rel-(1R,5S)-8-[(4-chloro-2-methylphenoxy)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}pyridine-4-carboxamide
Compound characteristics
| Compound ID: | T651-0802 |
| Compound Name: | N-{rel-(1R,5S)-8-[(4-chloro-2-methylphenoxy)acetyl]-8-azabicyclo[3.2.1]octan-3-yl}pyridine-4-carboxamide |
| Molecular Weight: | 413.9 |
| Molecular Formula: | C22 H24 Cl N3 O3 |
| Smiles: | Cc1cc(ccc1OCC(N1[C@H]2CC[C@@H]1CC(C2)NC(c1ccncc1)=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3575 |
| logD: | 2.3571 |
| logSw: | -3.3095 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.192 |
| InChI Key: | HSJNVJGKGCVSFC-YQQQUEKLSA-N |