N-[rel-(3R,4R)-1-[(2,3-dimethoxyphenyl)methyl]-4-(hydroxymethyl)piperidin-3-yl]benzamide
Chemical Structure Depiction of
N-[rel-(3R,4R)-1-[(2,3-dimethoxyphenyl)methyl]-4-(hydroxymethyl)piperidin-3-yl]benzamide
N-[rel-(3R,4R)-1-[(2,3-dimethoxyphenyl)methyl]-4-(hydroxymethyl)piperidin-3-yl]benzamide
Compound characteristics
| Compound ID: | S617-0897 |
| Compound Name: | N-[rel-(3R,4R)-1-[(2,3-dimethoxyphenyl)methyl]-4-(hydroxymethyl)piperidin-3-yl]benzamide |
| Molecular Weight: | 384.47 |
| Molecular Formula: | C22 H28 N2 O4 |
| Smiles: | COc1cccc(CN2CC[C@H](CO)[C@@H](C2)NC(c2ccccc2)=O)c1OC |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.1186 |
| logD: | 1.1659 |
| logSw: | -2.4822 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.704 |
| InChI Key: | DABUCFJXOUOPSX-OALUTQOASA-N |