N-{[rel-(3R,4S)-1-(5-bromopyridine-3-carbonyl)-3-(dimethylamino)piperidin-4-yl]methyl}acetamide
Chemical Structure Depiction of
N-{[rel-(3R,4S)-1-(5-bromopyridine-3-carbonyl)-3-(dimethylamino)piperidin-4-yl]methyl}acetamide
N-{[rel-(3R,4S)-1-(5-bromopyridine-3-carbonyl)-3-(dimethylamino)piperidin-4-yl]methyl}acetamide
Compound characteristics
| Compound ID: | S618-0533 |
| Compound Name: | N-{[rel-(3R,4S)-1-(5-bromopyridine-3-carbonyl)-3-(dimethylamino)piperidin-4-yl]methyl}acetamide |
| Molecular Weight: | 383.29 |
| Molecular Formula: | C16 H23 Br N4 O2 |
| Smiles: | CC(NC[C@H]1CCN(C[C@H]1N(C)C)C(c1cc(cnc1)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.2546 |
| logD: | -0.5819 |
| logSw: | -1.4075 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.923 |
| InChI Key: | YHJDXTZPSBARQW-DOMZBBRYSA-N |