{4-[rel-(3R,4R)-4-(hydroxymethyl)pyrrolidin-3-yl]piperidin-1-yl}(3-methoxy-2-methylphenyl)methanone--hydrogen chloride (1/1)
Chemical Structure Depiction of
{4-[rel-(3R,4R)-4-(hydroxymethyl)pyrrolidin-3-yl]piperidin-1-yl}(3-methoxy-2-methylphenyl)methanone--hydrogen chloride (1/1)
{4-[rel-(3R,4R)-4-(hydroxymethyl)pyrrolidin-3-yl]piperidin-1-yl}(3-methoxy-2-methylphenyl)methanone--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | S632-1239 |
| Compound Name: | {4-[rel-(3R,4R)-4-(hydroxymethyl)pyrrolidin-3-yl]piperidin-1-yl}(3-methoxy-2-methylphenyl)methanone--hydrogen chloride (1/1) |
| Molecular Weight: | 368.9 |
| Molecular Formula: | C19 H28 N2 O3 |
| Salt: | HCl |
| Smiles: | Cc1c(cccc1OC)C(N1CCC(CC1)[C@@H]1CNC[C@H]1CO)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.5587 |
| logD: | -1.7833 |
| logSw: | -2.1749 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.742 |
| InChI Key: | ZDVXOTNJPMJPGY-NVXWUHKLSA-N |