5-Doxylstearic acid methyl ester
TL;DR: 5-Doxylstearic acid methyl ester (CAS 38568-24-0) is a chemical compound with molecular formula C23H44NO4 and molecular weight 398.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: 5-Doxylstearic acid methyl ester, 5-Doxylstearate methyl ester, 5-MeSL, Methyl 5-doxylstearate, methyl 4-(3-
| Molecular Formula | C23H44NO4 |
|---|---|
| Molecular Weight | 398.33 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 39.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 17 |
| Exact Mass | 398.32703 |
| Heavy Atoms | 28 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 38568-24-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCC1(N(C(CO1)(C)C)[O])CCCC(=O)OC |
| InChIKey | XKWHHWBOJRTEHX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Doxylstearic acid methyl ester (CAS 38568-24-0), with molecular formula C23H44NO4 and molecular weight 398.33 g/mol.
Chemical Property Profile of 5-Doxylstearic acid methyl ester
Property Insights of 5-Doxylstearic acid methyl ester
The XLogP value of 7.2 indicates that 5-Doxylstearic acid methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.8 Ų, 5-Doxylstearic acid methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Doxylstearic acid methyl ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Doxylstearic acid methyl ester?
The CAS number of 5-Doxylstearic acid methyl ester is 38568-24-0.
What is the molecular formula of 5-Doxylstearic acid methyl ester?
The molecular formula of 5-Doxylstearic acid methyl ester is C23H44NO4.
What is the molecular weight of 5-Doxylstearic acid methyl ester?
The molecular weight of 5-Doxylstearic acid methyl ester is 398.33 g/mol.
Where can I buy 5-Doxylstearic acid methyl ester?
You can request a quote for 5-Doxylstearic acid methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Doxylstearic acid methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 5-Doxylstearic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.