N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1-ethyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1-ethyl-1H-pyrazole-4-carboxamide
N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1-ethyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | S823-0983 |
| Compound Name: | N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1-ethyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 328.41 |
| Molecular Formula: | C18 H24 N4 O2 |
| Smiles: | CCn1cc(cn1)C(N[C@@H]1CN(Cc2ccccc2)C[C@H]1CO)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.5734 |
| logD: | -0.7925 |
| logSw: | -1.6584 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.158 |
| InChI Key: | XNKOPAVRILPCNG-DLBZAZTESA-N |