N-[rel-(1R,5S)-8-(4-chloro-2-methylbenzene-1-sulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]pyridine-4-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,5S)-8-(4-chloro-2-methylbenzene-1-sulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]pyridine-4-carboxamide
N-[rel-(1R,5S)-8-(4-chloro-2-methylbenzene-1-sulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]pyridine-4-carboxamide
Compound characteristics
| Compound ID: | T651-0783 |
| Compound Name: | N-[rel-(1R,5S)-8-(4-chloro-2-methylbenzene-1-sulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]pyridine-4-carboxamide |
| Molecular Weight: | 419.93 |
| Molecular Formula: | C20 H22 Cl N3 O3 S |
| Smiles: | Cc1cc(ccc1S(N1[C@H]2CC[C@@H]1CC(C2)NC(c1ccncc1)=O)(=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.4489 |
| logD: | 2.4485 |
| logSw: | -3.4458 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.75 |
| InChI Key: | YQZAJSJSTOYPML-AYHJJNSGSA-N |