N-{rel-(1R,5S)-8-[3-(1,3-benzothiazol-2-yl)propanoyl]-8-azabicyclo[3.2.1]octan-3-yl}pyridine-4-carboxamide
Chemical Structure Depiction of
N-{rel-(1R,5S)-8-[3-(1,3-benzothiazol-2-yl)propanoyl]-8-azabicyclo[3.2.1]octan-3-yl}pyridine-4-carboxamide
N-{rel-(1R,5S)-8-[3-(1,3-benzothiazol-2-yl)propanoyl]-8-azabicyclo[3.2.1]octan-3-yl}pyridine-4-carboxamide
Compound characteristics
| Compound ID: | T651-0817 |
| Compound Name: | N-{rel-(1R,5S)-8-[3-(1,3-benzothiazol-2-yl)propanoyl]-8-azabicyclo[3.2.1]octan-3-yl}pyridine-4-carboxamide |
| Molecular Weight: | 420.53 |
| Molecular Formula: | C23 H24 N4 O2 S |
| Smiles: | C(Cc1nc2ccccc2s1)C(N1[C@H]2CC[C@@H]1CC(C2)NC(c1ccncc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.9079 |
| logD: | 1.9075 |
| logSw: | -1.9805 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.822 |
| InChI Key: | GSZFDMWCMPOHKV-AYHJJNSGSA-N |