N-[rel-(3R,4R)-4-(hydroxymethyl)-1-(4-methylbenzoyl)piperidin-3-yl]benzamide
Chemical Structure Depiction of
N-[rel-(3R,4R)-4-(hydroxymethyl)-1-(4-methylbenzoyl)piperidin-3-yl]benzamide
N-[rel-(3R,4R)-4-(hydroxymethyl)-1-(4-methylbenzoyl)piperidin-3-yl]benzamide
Compound characteristics
Compound ID: | S617-0051 |
Compound Name: | N-[rel-(3R,4R)-4-(hydroxymethyl)-1-(4-methylbenzoyl)piperidin-3-yl]benzamide |
Molecular Weight: | 352.43 |
Molecular Formula: | C21 H24 N2 O3 |
Smiles: | Cc1ccc(cc1)C(N1CC[C@H](CO)[C@@H](C1)NC(c1ccccc1)=O)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 1.9993 |
logD: | 1.9993 |
logSw: | -2.2872 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 58.272 |
InChI Key: | NSWXKYGSRSOPHY-MOPGFXCFSA-N |