N-[rel-(3R,4S)-1-benzyl-4-(methylcarbamoyl)pyrrolidin-3-yl]-3-methylpyridine-2-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-benzyl-4-(methylcarbamoyl)pyrrolidin-3-yl]-3-methylpyridine-2-carboxamide
N-[rel-(3R,4S)-1-benzyl-4-(methylcarbamoyl)pyrrolidin-3-yl]-3-methylpyridine-2-carboxamide
Compound characteristics
| Compound ID: | S963-2536 |
| Compound Name: | N-[rel-(3R,4S)-1-benzyl-4-(methylcarbamoyl)pyrrolidin-3-yl]-3-methylpyridine-2-carboxamide |
| Molecular Weight: | 352.43 |
| Molecular Formula: | C20 H24 N4 O2 |
| Smiles: | Cc1cccnc1C(N[C@H]1CN(Cc2ccccc2)C[C@@H]1C(NC)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.8718 |
| logD: | -0.1741 |
| logSw: | -2.1549 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.194 |
| InChI Key: | GGXYHXCFFGAPPE-IRXDYDNUSA-N |