N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1-methyl-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1-methyl-1H-pyrrole-2-carboxamide
N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1-methyl-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | S823-0862 |
| Compound Name: | N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1-methyl-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 313.4 |
| Molecular Formula: | C18 H23 N3 O2 |
| Smiles: | Cn1cccc1C(N[C@@H]1CN(Cc2ccccc2)C[C@H]1CO)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.8655 |
| logD: | 0.1758 |
| logSw: | -2.1096 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.072 |
| InChI Key: | ARKNYDTWHIZFLN-CVEARBPZSA-N |