rel-(2R,3S)-4-cyclopropyl-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-oxo-3-phenylmorpholine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,3S)-4-cyclopropyl-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-oxo-3-phenylmorpholine-2-carboxamide
rel-(2R,3S)-4-cyclopropyl-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-oxo-3-phenylmorpholine-2-carboxamide
Compound characteristics
| Compound ID: | S681-0536 |
| Compound Name: | rel-(2R,3S)-4-cyclopropyl-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-oxo-3-phenylmorpholine-2-carboxamide |
| Molecular Weight: | 433.55 |
| Molecular Formula: | C26 H31 N3 O3 |
| Smiles: | C(CNC([C@H]1[C@H](c2ccccc2)N(C2CC2)C(CO1)=O)=O)CN1CCc2ccccc2C1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.6144 |
| logD: | 1.4103 |
| logSw: | -2.9137 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.62 |
| InChI Key: | HCERGBWNOCWOGB-JWQCQUIFSA-N |