1-O-decylpropanediyl-3-phosphorylcholine
TL;DR: 1-O-decylpropanediyl-3-phosphorylcholine (CAS 15960-39-1) is a chemical compound with molecular formula C18H38NO7P and molecular weight 411.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-decanoyloxy-2-hydroxypropyl) 2-(trimethylazaniumyl)ethyl phosphate
Also Known As: We 205, 1-O-Decylpropanediyl-3-phosphorylcholine, 1-decanoyl-sn-glycero-3-phosphocholine, LPC 10:0, 1-Capryl-2-hydroxy-SN-glycero-3-phosphochoine
| Molecular Formula | C18H38NO7P |
|---|---|
| Molecular Weight | 411.24 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 18 |
| Exact Mass | 411.2386 |
| Heavy Atoms | 27 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 15960-39-1 |
|---|---|
| SMILES | CCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)O |
| InChIKey | SECPDKKEUKDCPG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-O-decylpropanediyl-3-phosphorylcholine (CAS 15960-39-1), with molecular formula C18H38NO7P and molecular weight 411.24 g/mol. IUPAC: (3-decanoyloxy-2-hydroxypropyl) 2-(trimethylazaniumyl)ethyl phosphate.
Chemical Property Profile of 1-O-decylpropanediyl-3-phosphorylcholine
Property Insights of 1-O-decylpropanediyl-3-phosphorylcholine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-O-decylpropanediyl-3-phosphorylcholine. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-O-decylpropanediyl-3-phosphorylcholine. Following Lipinski's Rule of Five, 1-O-decylpropanediyl-3-phosphorylcholine has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-O-decylpropanediyl-3-phosphorylcholine?
The CAS number of 1-O-decylpropanediyl-3-phosphorylcholine is 15960-39-1.
What is the molecular formula of 1-O-decylpropanediyl-3-phosphorylcholine?
The molecular formula of 1-O-decylpropanediyl-3-phosphorylcholine is C18H38NO7P.
What is the molecular weight of 1-O-decylpropanediyl-3-phosphorylcholine?
The molecular weight of 1-O-decylpropanediyl-3-phosphorylcholine is 411.24 g/mol.
Where can I buy 1-O-decylpropanediyl-3-phosphorylcholine?
You can request a quote for 1-O-decylpropanediyl-3-phosphorylcholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-O-decylpropanediyl-3-phosphorylcholine?
Yes, KEHONG BIO provides custom synthesis services for 1-O-decylpropanediyl-3-phosphorylcholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.