N-[rel-(3R,4S)-1-(2,3-dimethoxybenzoyl)-4-(hydroxymethyl)pyrrolidin-3-yl]acetamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-(2,3-dimethoxybenzoyl)-4-(hydroxymethyl)pyrrolidin-3-yl]acetamide
N-[rel-(3R,4S)-1-(2,3-dimethoxybenzoyl)-4-(hydroxymethyl)pyrrolidin-3-yl]acetamide
Compound characteristics
| Compound ID: | S823-4631 |
| Compound Name: | N-[rel-(3R,4S)-1-(2,3-dimethoxybenzoyl)-4-(hydroxymethyl)pyrrolidin-3-yl]acetamide |
| Molecular Weight: | 322.36 |
| Molecular Formula: | C16 H22 N2 O5 |
| Smiles: | CC(N[C@@H]1CN(C[C@H]1CO)C(c1cccc(c1OC)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.2845 |
| logD: | -0.2845 |
| logSw: | -1.962 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.09 |
| InChI Key: | MCYUVBIHXUNOPH-WCQYABFASA-N |