1-{2-[(3,6-dichloropyridine-2-carbonyl)amino]ethyl}-1-dodecylpiperidin-1-ium--bromide (1/1)
Chemical Structure Depiction of
1-{2-[(3,6-dichloropyridine-2-carbonyl)amino]ethyl}-1-dodecylpiperidin-1-ium--bromide (1/1)
1-{2-[(3,6-dichloropyridine-2-carbonyl)amino]ethyl}-1-dodecylpiperidin-1-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 8013-4241 |
| Compound Name: | 1-{2-[(3,6-dichloropyridine-2-carbonyl)amino]ethyl}-1-dodecylpiperidin-1-ium--bromide (1/1) |
| Molecular Weight: | 551.44 |
| Molecular Formula: | C25 H42 Cl2 N3 O |
| Salt: | Br- |
| Smiles: | CCCCCCCCCCCC[N+]1(CCCCC1)CCNC(c1c(ccc(n1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 7.4657 |
| logD: | 7.4641 |
| logSw: | -6.4416 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.895 |
| InChI Key: | SQUAAOAOHYSTDH-UHFFFAOYSA-O |