rel-(3R,4S)-N-[(2-ethoxyphenyl)methyl]-1-(methanesulfonyl)-4-(pyridin-4-yl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4S)-N-[(2-ethoxyphenyl)methyl]-1-(methanesulfonyl)-4-(pyridin-4-yl)pyrrolidine-3-carboxamide
rel-(3R,4S)-N-[(2-ethoxyphenyl)methyl]-1-(methanesulfonyl)-4-(pyridin-4-yl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | T866-1797 |
| Compound Name: | rel-(3R,4S)-N-[(2-ethoxyphenyl)methyl]-1-(methanesulfonyl)-4-(pyridin-4-yl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C20 H25 N3 O4 S |
| Smiles: | CCOc1ccccc1CNC([C@@H]1CN(C[C@H]1c1ccncc1)S(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.528 |
| logD: | 1.5188 |
| logSw: | -2.2992 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.727 |
| InChI Key: | CKYBUZIRRCTZNV-ZWKOTPCHSA-N |