rel-(5R,6S)-6-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-5-phenylmorpholin-3-one
Chemical Structure Depiction of
rel-(5R,6S)-6-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-5-phenylmorpholin-3-one
rel-(5R,6S)-6-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-5-phenylmorpholin-3-one
Compound characteristics
| Compound ID: | S681-0188 |
| Compound Name: | rel-(5R,6S)-6-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-5-phenylmorpholin-3-one |
| Molecular Weight: | 336.39 |
| Molecular Formula: | C20 H20 N2 O3 |
| Smiles: | C1CN(Cc2ccccc12)C([C@H]1[C@H](c2ccccc2)NC(CO1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.972 |
| logD: | 1.972 |
| logSw: | -2.3457 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.049 |
| InChI Key: | CIPQNUGZYZVWKM-RTBURBONSA-N |