Ethyl 2-(undecanoylamino)benzoate
TL;DR: Ethyl 2-(undecanoylamino)benzoate (CAS 544466-24-2) is a chemical compound with molecular formula C20H31NO3 and molecular weight 333.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(undecanoylamino)benzoate
Also Known As: ethyl 2-(undecanoylamino)benzoate, AN-652/42191027
| Molecular Formula | C20H31NO3 |
|---|---|
| Molecular Weight | 333.23 g/mol |
| LogP | 5.3326 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 333.2304 |
| Heavy Atoms | 24 |
| Complexity | 499.41226 |
Chemical Identifiers
| CAS Number | 544466-24-2 |
|---|---|
| SMILES | CCCCCCCCCCC(=O)NC1=CC=CC=C1C(=O)OCC |
Product Overview
Ethyl 2-(undecanoylamino)benzoate (CAS 544466-24-2), with molecular formula C20H31NO3 and molecular weight 333.23 g/mol. IUPAC: ethyl 2-(undecanoylamino)benzoate.
Chemical Property Profile of Ethyl 2-(undecanoylamino)benzoate
Property Insights of Ethyl 2-(undecanoylamino)benzoate
The XLogP value of 5.3326 indicates that Ethyl 2-(undecanoylamino)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl 2-(undecanoylamino)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(undecanoylamino)benzoate 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 Ethyl 2-(undecanoylamino)benzoate?
The CAS number of Ethyl 2-(undecanoylamino)benzoate is 544466-24-2.
What is the molecular formula of Ethyl 2-(undecanoylamino)benzoate?
The molecular formula of Ethyl 2-(undecanoylamino)benzoate is C20H31NO3.
What is the molecular weight of Ethyl 2-(undecanoylamino)benzoate?
The molecular weight of Ethyl 2-(undecanoylamino)benzoate is 333.23 g/mol.
Where can I buy Ethyl 2-(undecanoylamino)benzoate?
You can request a quote for Ethyl 2-(undecanoylamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(undecanoylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(undecanoylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.