TL;DR: 1-Dodecyl-2-(hydroxymethyl)piperidine-3,4,5-triol (CAS 1323254-04-1) is a chemical compound with molecular formula C18H37NO4 and molecular weight 331.27225 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-dodecyl-2-(hydroxymethyl)piperidine-3,4,5-triol
Also Known As: N-dodecyldeoxynojirimycin, 1-dodecyl-2-(hydroxymethyl)piperidine-3,4,5-triol
| Molecular Formula | C18H37NO4 |
| Molecular Weight | 331.27225 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 84.2 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 331.27225 Da |
| Heavy Atoms | 23 |
| Complexity | 290.0 |
| SMILES | CCCCCCCCCCCCN1CC(C(C(C1CO)O)O)O |
| InChIKey | TYXAKMAAZJJHCB-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that 1-Dodecyl-2-(hydroxymethyl)piperidine-3,4,5-triol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Dodecyl-2-(hydroxymethyl)piperidine-3,4,5-triol. Following Lipinski's Rule of Five, 1-Dodecyl-2-(hydroxymethyl)piperidine-3,4,5-triol has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Dodecyl-2-(hydroxymethyl)piperidine-3,4,5-triol is 1323254-04-1.
The molecular formula of 1-Dodecyl-2-(hydroxymethyl)piperidine-3,4,5-triol is C18H37NO4.
The molecular weight of 1-Dodecyl-2-(hydroxymethyl)piperidine-3,4,5-triol is 331.27225 g/mol.
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