rel-(3R,4S)-1-benzyl-4-[(4-methylphenyl)carbamoyl]pyrrolidine-3-carboxylic acid
Chemical Structure Depiction of
rel-(3R,4S)-1-benzyl-4-[(4-methylphenyl)carbamoyl]pyrrolidine-3-carboxylic acid
rel-(3R,4S)-1-benzyl-4-[(4-methylphenyl)carbamoyl]pyrrolidine-3-carboxylic acid
Compound characteristics
| Compound ID: | S719-0021 |
| Compound Name: | rel-(3R,4S)-1-benzyl-4-[(4-methylphenyl)carbamoyl]pyrrolidine-3-carboxylic acid |
| Molecular Weight: | 338.4 |
| Molecular Formula: | C20 H22 N2 O3 |
| Smiles: | Cc1ccc(cc1)NC([C@H]1CN(Cc2ccccc2)C[C@H]1C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3769 |
| logD: | -0.3046 |
| logSw: | -2.9453 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.703 |
| InChI Key: | ULKOGSWRIATCFN-MSOLQXFVSA-N |