N-[rel-(3R,4R)-4-(hydroxymethyl)-1-(5-methylthiophene-2-carbonyl)piperidin-3-yl]pyridine-3-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4R)-4-(hydroxymethyl)-1-(5-methylthiophene-2-carbonyl)piperidin-3-yl]pyridine-3-carboxamide
N-[rel-(3R,4R)-4-(hydroxymethyl)-1-(5-methylthiophene-2-carbonyl)piperidin-3-yl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | S617-0441 |
| Compound Name: | N-[rel-(3R,4R)-4-(hydroxymethyl)-1-(5-methylthiophene-2-carbonyl)piperidin-3-yl]pyridine-3-carboxamide |
| Molecular Weight: | 359.45 |
| Molecular Formula: | C18 H21 N3 O3 S |
| Smiles: | Cc1ccc(C(N2CC[C@H](CO)[C@@H](C2)NC(c2cccnc2)=O)=O)s1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2652 |
| logD: | 1.2652 |
| logSw: | -1.4356 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.808 |
| InChI Key: | MHMDBQYLWNUALZ-CABCVRRESA-N |