(Methylimino)diethane-1,2-diyl distearate
TL;DR: (Methylimino)diethane-1,2-diyl distearate (CAS 13998-76-0) is a chemical compound with molecular formula C41H81NO4 and molecular weight 651.62 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[methyl(2-octadecanoyloxyethyl)amino]ethyl octadecanoate
Also Known As: (Methylimino)diethane-1,2-diyl distearate, 2-[methyl(2-octadecanoyloxyethyl)amino]ethyl octadecanoate, (methylimino)diethane-2,1-diyl dioctadecanoate, (Methylazanediyl)di(ethane-2,1-diyl) dioctadecanoate, Dioctadecanoic acid methyliminobis(2,1-ethanediyl) ester
| Molecular Formula | C41H81NO4 |
|---|---|
| Molecular Weight | 651.62 g/mol |
| LogP | 16.9 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 40 |
| Exact Mass | 651.6166 |
| Heavy Atoms | 46 |
| Complexity | 574.0 |
Chemical Identifiers
| CAS Number | 13998-76-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCCN(C)CCOC(=O)CCCCCCCCCCCCCCCCC |
| InChIKey | TZMDJYBJDWYXPR-UHFFFAOYSA-N |
Product Overview
(Methylimino)diethane-1,2-diyl distearate (CAS 13998-76-0), with molecular formula C41H81NO4 and molecular weight 651.62 g/mol. IUPAC: 2-[methyl(2-octadecanoyloxyethyl)amino]ethyl octadecanoate.
Chemical Property Profile of (Methylimino)diethane-1,2-diyl distearate
Property Insights of (Methylimino)diethane-1,2-diyl distearate
The XLogP value of 16.9 indicates that (Methylimino)diethane-1,2-diyl distearate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, (Methylimino)diethane-1,2-diyl distearate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Methylimino)diethane-1,2-diyl distearate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Methylimino)diethane-1,2-diyl distearate?
The CAS number of (Methylimino)diethane-1,2-diyl distearate is 13998-76-0.
What is the molecular formula of (Methylimino)diethane-1,2-diyl distearate?
The molecular formula of (Methylimino)diethane-1,2-diyl distearate is C41H81NO4.
What is the molecular weight of (Methylimino)diethane-1,2-diyl distearate?
The molecular weight of (Methylimino)diethane-1,2-diyl distearate is 651.62 g/mol.
Where can I buy (Methylimino)diethane-1,2-diyl distearate?
You can request a quote for (Methylimino)diethane-1,2-diyl distearate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Methylimino)diethane-1,2-diyl distearate?
Yes, KEHONG BIO provides custom synthesis services for (Methylimino)diethane-1,2-diyl distearate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.