N-[rel-(3R,4S)-1-benzyl-4-(methylcarbamoyl)pyrrolidin-3-yl]-6-methylpyridine-2-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-benzyl-4-(methylcarbamoyl)pyrrolidin-3-yl]-6-methylpyridine-2-carboxamide
N-[rel-(3R,4S)-1-benzyl-4-(methylcarbamoyl)pyrrolidin-3-yl]-6-methylpyridine-2-carboxamide
Compound characteristics
| Compound ID: | S963-2593 |
| Compound Name: | N-[rel-(3R,4S)-1-benzyl-4-(methylcarbamoyl)pyrrolidin-3-yl]-6-methylpyridine-2-carboxamide |
| Molecular Weight: | 352.43 |
| Molecular Formula: | C20 H24 N4 O2 |
| Smiles: | Cc1cccc(C(N[C@H]2CN(Cc3ccccc3)C[C@@H]2C(NC)=O)=O)n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.9979 |
| logD: | -0.0481 |
| logSw: | -2.1204 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.798 |
| InChI Key: | FRSPWBGTXVJJLR-WMZOPIPTSA-N |