![4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate structure](/static/products/940/94006-15-2.png)
4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate
TL;DR: 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate (CAS 94006-15-2) is a chemical compound with molecular formula C26H49N2O4- and molecular weight 453.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate
Also Known As: EINECS 301-352-0, 4-[acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate, 2-[(ACETYL)[2-(STEAROYLAMINO)ETHYL]AMINO]ETHYLACETATE
| Molecular Formula | C26H49N2O4- |
|---|---|
| Molecular Weight | 453.37 g/mol |
| LogP | 4.7427 |
| Topological Polar Surface Area | 89.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 23 |
| Exact Mass | 453.36923 |
| Heavy Atoms | 32 |
| Complexity | 482.44733 |
Chemical Identifiers
| CAS Number | 94006-15-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)NCCN(CCCC(=O)[O-])C(=O)C |
Product Overview
4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate (CAS 94006-15-2), with molecular formula C26H49N2O4- and molecular weight 453.37 g/mol. IUPAC: 4-[acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate.
Chemical Property Profile of 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate
Property Insights of 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate
The XLogP value of 4.7427 indicates that 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate. Following Lipinski's Rule of Five, 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate has 1 hydrogen bond donor(s) and 4 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 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate?
The CAS number of 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate is 94006-15-2.
What is the molecular formula of 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate?
The molecular formula of 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate is C26H49N2O4-.
What is the molecular weight of 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate?
The molecular weight of 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate is 453.37 g/mol.
Where can I buy 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate?
You can request a quote for 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate?
Yes, KEHONG BIO provides custom synthesis services for 4-[Acetyl-[2-(octadecanoylamino)ethyl]amino]butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.