rel-(3R,4S)-1-benzyl-4-[(2,4-difluorophenyl)carbamoyl]pyrrolidine-3-carboxylic acid
Chemical Structure Depiction of
rel-(3R,4S)-1-benzyl-4-[(2,4-difluorophenyl)carbamoyl]pyrrolidine-3-carboxylic acid
rel-(3R,4S)-1-benzyl-4-[(2,4-difluorophenyl)carbamoyl]pyrrolidine-3-carboxylic acid
Compound characteristics
| Compound ID: | S719-0028 |
| Compound Name: | rel-(3R,4S)-1-benzyl-4-[(2,4-difluorophenyl)carbamoyl]pyrrolidine-3-carboxylic acid |
| Molecular Weight: | 360.36 |
| Molecular Formula: | C19 H18 F2 N2 O3 |
| Smiles: | C(c1ccccc1)N1C[C@@H](C(O)=O)[C@H](C1)C(Nc1ccc(cc1F)F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.1679 |
| logD: | -0.5135 |
| logSw: | -2.833 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.005 |
| InChI Key: | DVGUHHKKGFNTNB-CABCVRRESA-N |