N-[rel-(3R,4S)-1-benzyl-4-(methylcarbamoyl)pyrrolidin-3-yl]-1-methyl-1H-imidazole-4-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-benzyl-4-(methylcarbamoyl)pyrrolidin-3-yl]-1-methyl-1H-imidazole-4-carboxamide
N-[rel-(3R,4S)-1-benzyl-4-(methylcarbamoyl)pyrrolidin-3-yl]-1-methyl-1H-imidazole-4-carboxamide
Compound characteristics
| Compound ID: | S963-2563 |
| Compound Name: | N-[rel-(3R,4S)-1-benzyl-4-(methylcarbamoyl)pyrrolidin-3-yl]-1-methyl-1H-imidazole-4-carboxamide |
| Molecular Weight: | 341.41 |
| Molecular Formula: | C18 H23 N5 O2 |
| Smiles: | CNC([C@H]1CN(Cc2ccccc2)C[C@@H]1NC(c1cn(C)cn1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.2627 |
| logD: | -1.3086 |
| logSw: | -1.8819 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.012 |
| InChI Key: | IDXHHRZHXLVPTG-GJZGRUSLSA-N |