N-[rel-(1R,5S)-8-(2,5-dimethoxybenzene-1-sulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]pyridine-4-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,5S)-8-(2,5-dimethoxybenzene-1-sulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]pyridine-4-carboxamide
N-[rel-(1R,5S)-8-(2,5-dimethoxybenzene-1-sulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]pyridine-4-carboxamide
Compound characteristics
| Compound ID: | T651-0336 |
| Compound Name: | N-[rel-(1R,5S)-8-(2,5-dimethoxybenzene-1-sulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]pyridine-4-carboxamide |
| Molecular Weight: | 431.51 |
| Molecular Formula: | C21 H25 N3 O5 S |
| Smiles: | COc1ccc(c(c1)S(N1[C@H]2CC[C@@H]1CC(C2)NC(c1ccncc1)=O)(=O)=O)OC |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0488 |
| logD: | 1.0483 |
| logSw: | -2.0252 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.924 |
| InChI Key: | IKMCRUHDXDTSCV-ALOPSCKCSA-N |