rel-(3R,4S)-1-benzyl-4-{methyl[2-(methylamino)-2-oxoethyl]carbamoyl}pyrrolidine-3-carboxylic acid
Chemical Structure Depiction of
rel-(3R,4S)-1-benzyl-4-{methyl[2-(methylamino)-2-oxoethyl]carbamoyl}pyrrolidine-3-carboxylic acid
rel-(3R,4S)-1-benzyl-4-{methyl[2-(methylamino)-2-oxoethyl]carbamoyl}pyrrolidine-3-carboxylic acid
Compound characteristics
| Compound ID: | S837-1362 |
| Compound Name: | rel-(3R,4S)-1-benzyl-4-{methyl[2-(methylamino)-2-oxoethyl]carbamoyl}pyrrolidine-3-carboxylic acid |
| Molecular Weight: | 333.39 |
| Molecular Formula: | C17 H23 N3 O4 |
| Smiles: | CNC(CN(C)C([C@H]1CN(Cc2ccccc2)C[C@H]1C(O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.8065 |
| logD: | -0.8065 |
| logSw: | -1.8544 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.656 |
| InChI Key: | HMBXIDHWQHZCLF-KGLIPLIRSA-N |