rel-(2R,3S)-N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-5-oxo-3-phenylmorpholine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,3S)-N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-5-oxo-3-phenylmorpholine-2-carboxamide
rel-(2R,3S)-N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-5-oxo-3-phenylmorpholine-2-carboxamide
Compound characteristics
| Compound ID: | S681-0311 |
| Compound Name: | rel-(2R,3S)-N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-5-oxo-3-phenylmorpholine-2-carboxamide |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C21 H22 N4 O3 |
| Smiles: | CN1C(CO[C@@H](C(NCCc2nc3ccccc3[nH]2)=O)[C@@H]1c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.263 |
| logD: | 1.2495 |
| logSw: | -1.7514 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.742 |
| InChI Key: | DORYOCAKEBXEIJ-WOJBJXKFSA-N |