rel-(3R,4S)-4-acetamido-1-[(3-chlorophenyl)acetyl]-N-methylpyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4S)-4-acetamido-1-[(3-chlorophenyl)acetyl]-N-methylpyrrolidine-3-carboxamide
rel-(3R,4S)-4-acetamido-1-[(3-chlorophenyl)acetyl]-N-methylpyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S963-3900 |
| Compound Name: | rel-(3R,4S)-4-acetamido-1-[(3-chlorophenyl)acetyl]-N-methylpyrrolidine-3-carboxamide |
| Molecular Weight: | 337.8 |
| Molecular Formula: | C16 H20 Cl N3 O3 |
| Smiles: | CC(N[C@H]1CN(C[C@@H]1C(NC)=O)C(Cc1cccc(c1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.29 |
| logD: | 0.29 |
| logSw: | -2.3784 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.935 |
| InChI Key: | UIIODNIUYRUBHM-ZIAGYGMSSA-N |