N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1-ethyl-5-methyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1-ethyl-5-methyl-1H-pyrazole-4-carboxamide
N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1-ethyl-5-methyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | S823-0984 |
| Compound Name: | N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1-ethyl-5-methyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 342.44 |
| Molecular Formula: | C19 H26 N4 O2 |
| Smiles: | CCn1c(C)c(cn1)C(N[C@@H]1CN(Cc2ccccc2)C[C@H]1CO)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.248 |
| logD: | -0.1179 |
| logSw: | -2.0843 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.581 |
| InChI Key: | ULFPFPQMBFBLCC-AEFFLSMTSA-N |