rel-(2R,3S)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-(methoxymethyl)-1-methyl-6-oxopiperidine-3-carboxamide
Chemical Structure Depiction of
rel-(2R,3S)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-(methoxymethyl)-1-methyl-6-oxopiperidine-3-carboxamide
rel-(2R,3S)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-(methoxymethyl)-1-methyl-6-oxopiperidine-3-carboxamide
Compound characteristics
| Compound ID: | S760-0376 |
| Compound Name: | rel-(2R,3S)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-2-(methoxymethyl)-1-methyl-6-oxopiperidine-3-carboxamide |
| Molecular Weight: | 373.49 |
| Molecular Formula: | C21 H31 N3 O3 |
| Smiles: | CN1C(CC[C@@H](C(NCCCN2CCc3ccccc3C2)=O)[C@H]1COC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.8465 |
| logD: | -0.3576 |
| logSw: | -2.4586 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.785 |
| InChI Key: | MGLGPYUAFNSFCB-MOPGFXCFSA-N |