rel-(2R,3S)-1-benzyl-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-(methoxymethyl)piperidine-3-carboxamide
Chemical Structure Depiction of
rel-(2R,3S)-1-benzyl-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-(methoxymethyl)piperidine-3-carboxamide
rel-(2R,3S)-1-benzyl-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-(methoxymethyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | S761-0358 |
| Compound Name: | rel-(2R,3S)-1-benzyl-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-(methoxymethyl)piperidine-3-carboxamide |
| Molecular Weight: | 435.61 |
| Molecular Formula: | C27 H37 N3 O2 |
| Smiles: | COC[C@@H]1[C@@H](CCCN1Cc1ccccc1)C(NCCCN1CCc2ccccc2C1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.1052 |
| logD: | 1.9012 |
| logSw: | -3.1284 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.93 |
| InChI Key: | KPPTVYUKQNNKHM-UIOOFZCWSA-N |