Stearoyl methyl beta-alanine
TL;DR: Stearoyl methyl beta-alanine (CAS 13222-32-7) is a chemical compound with molecular formula C22H43NO3 and molecular weight 369.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[methyl(octadecanoyl)amino]propanoic acid
Also Known As: Stearoyl methyl beta-alanine, Arachidoyl glycine, N-Methyl-N-(1-oxooctadecyl)-beta-alanine, starbld0002063, 3-[methyl(octadecanoyl)amino]propanoic acid
| Molecular Formula | C22H43NO3 |
|---|---|
| Molecular Weight | 369.32 g/mol |
| LogP | 7.6 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 19 |
| Exact Mass | 369.32428 |
| Heavy Atoms | 26 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 13222-32-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)N(C)CCC(=O)O |
| InChIKey | GMHCJCQMNYOULB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Stearoyl methyl beta-alanine (CAS 13222-32-7), with molecular formula C22H43NO3 and molecular weight 369.32 g/mol. IUPAC: 3-[methyl(octadecanoyl)amino]propanoic acid.
Chemical Property Profile of Stearoyl methyl beta-alanine
Property Insights of Stearoyl methyl beta-alanine
The XLogP value of 7.6 indicates that Stearoyl methyl beta-alanine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.6 Ų, Stearoyl methyl beta-alanine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Stearoyl methyl beta-alanine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Stearoyl methyl beta-alanine?
The CAS number of Stearoyl methyl beta-alanine is 13222-32-7.
What is the molecular formula of Stearoyl methyl beta-alanine?
The molecular formula of Stearoyl methyl beta-alanine is C22H43NO3.
What is the molecular weight of Stearoyl methyl beta-alanine?
The molecular weight of Stearoyl methyl beta-alanine is 369.32 g/mol.
Where can I buy Stearoyl methyl beta-alanine?
You can request a quote for Stearoyl methyl beta-alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Stearoyl methyl beta-alanine?
Yes, KEHONG BIO provides custom synthesis services for Stearoyl methyl beta-alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.