rel-(3R,4S)-1-benzyl-4-(thiomorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid
Chemical Structure Depiction of
rel-(3R,4S)-1-benzyl-4-(thiomorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid
rel-(3R,4S)-1-benzyl-4-(thiomorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid
Compound characteristics
| Compound ID: | S837-1455 |
| Compound Name: | rel-(3R,4S)-1-benzyl-4-(thiomorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid |
| Molecular Weight: | 334.44 |
| Molecular Formula: | C17 H22 N2 O3 S |
| Smiles: | C1CSCCN1C([C@H]1CN(Cc2ccccc2)C[C@H]1C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.7112 |
| logD: | 0.7112 |
| logSw: | -1.9875 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.26 |
| InChI Key: | VDOLVQLHVSOPQU-CABCVRRESA-N |