N-[rel-(3R,4S)-1-[(3-chloro-4-methoxyphenyl)acetyl]-4-(hydroxymethyl)pyrrolidin-3-yl]acetamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-[(3-chloro-4-methoxyphenyl)acetyl]-4-(hydroxymethyl)pyrrolidin-3-yl]acetamide
N-[rel-(3R,4S)-1-[(3-chloro-4-methoxyphenyl)acetyl]-4-(hydroxymethyl)pyrrolidin-3-yl]acetamide
Compound characteristics
| Compound ID: | S823-4045 |
| Compound Name: | N-[rel-(3R,4S)-1-[(3-chloro-4-methoxyphenyl)acetyl]-4-(hydroxymethyl)pyrrolidin-3-yl]acetamide |
| Molecular Weight: | 340.8 |
| Molecular Formula: | C16 H21 Cl N2 O4 |
| Smiles: | CC(N[C@@H]1CN(C[C@H]1CO)C(Cc1ccc(c(c1)[Cl])OC)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.4526 |
| logD: | 0.4526 |
| logSw: | -2.4549 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.845 |
| InChI Key: | NDUZXKFMLFOSRD-GXTWGEPZSA-N |