rel-(3R,4S)-1-benzyl-4-[(prop-2-en-1-yl)carbamoyl]pyrrolidine-3-carboxylic acid
Chemical Structure Depiction of
rel-(3R,4S)-1-benzyl-4-[(prop-2-en-1-yl)carbamoyl]pyrrolidine-3-carboxylic acid
rel-(3R,4S)-1-benzyl-4-[(prop-2-en-1-yl)carbamoyl]pyrrolidine-3-carboxylic acid
Compound characteristics
| Compound ID: | S719-0006 |
| Compound Name: | rel-(3R,4S)-1-benzyl-4-[(prop-2-en-1-yl)carbamoyl]pyrrolidine-3-carboxylic acid |
| Molecular Weight: | 288.34 |
| Molecular Formula: | C16 H20 N2 O3 |
| Smiles: | C=CCNC([C@H]1CN(Cc2ccccc2)C[C@H]1C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.5843 |
| logD: | 0.5843 |
| logSw: | -1.9184 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.138 |
| InChI Key: | GTSWYOUEDUNJSJ-KGLIPLIRSA-N |