1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine
TL;DR: 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine (CAS 91575-58-5) is a chemical compound with molecular formula C26H55N2O7P and molecular weight 538.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R)-3-hexadecoxy-2-(methylcarbamoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
Also Known As: Methylcarbamol, methylcarbamyl PAF, cPAF, Methylcarbamyl PAF C-16, mc-PAF
| Molecular Formula | C26H55N2O7P |
|---|---|
| Molecular Weight | 538.37 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 26 |
| Exact Mass | 538.3747 |
| Heavy Atoms | 36 |
| Complexity | 565.0 |
Chemical Identifiers
| CAS Number | 91575-58-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)NC |
| InChIKey | FNFHZBKBDFRYHS-RUZDIDTESA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine (CAS 91575-58-5), with molecular formula C26H55N2O7P and molecular weight 538.37 g/mol. IUPAC: [(2R)-3-hexadecoxy-2-(methylcarbamoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate.
Chemical Property Profile of 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine
Property Insights of 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine
The XLogP value of 6.3 indicates that 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine. Following Lipinski's Rule of Five, 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine?
The CAS number of 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine is 91575-58-5.
What is the molecular formula of 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine?
The molecular formula of 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine is C26H55N2O7P.
What is the molecular weight of 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine?
The molecular weight of 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine is 538.37 g/mol.
Where can I buy 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine?
You can request a quote for 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine?
Yes, KEHONG BIO provides custom synthesis services for 1-O-Hexadecyl-2-N-methylcarbamol-sn-glycerol-3-phosphocholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.