![Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate structure](/static/products/7109/710986-94-0.webp)
Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate
TL;DR: Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate (CAS 710986-94-0) is a chemical compound with molecular formula C22H26N2O4 and molecular weight 382.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[3-(2-ethylbutanoylamino)benzoyl]amino]benzoate
Also Known As: ethyl 4-(3-(2-ethylbutanamido)benzamido)benzoate, ETHYL 4-[3-(2-ETHYLBUTANAMIDO)BENZAMIDO]BENZOATE, ethyl 4-[[3-(2-ethylbutanoylamino)benzoyl]amino]benzoate, ethyl 4-[({3-[(2-ethylbutanoyl)amino]phenyl}carbonyl)amino]benzoate, ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate
| Molecular Formula | C22H26N2O4 |
|---|---|
| Molecular Weight | 382.19 g/mol |
| LogP | 4.4903 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 382.18927 |
| Heavy Atoms | 28 |
| Complexity | 826.6853 |
Chemical Identifiers
| CAS Number | 710986-94-0 |
|---|---|
| SMILES | CCC(CC)C(=O)NC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)OCC |
Product Overview
Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate (CAS 710986-94-0), with molecular formula C22H26N2O4 and molecular weight 382.19 g/mol. IUPAC: ethyl 4-[[3-(2-ethylbutanoylamino)benzoyl]amino]benzoate.
Chemical Property Profile of Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate
Property Insights of Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate
The XLogP value of 4.4903 indicates that Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate. Following Lipinski's Rule of Five, Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate has 2 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 Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate?
The CAS number of Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate is 710986-94-0.
What is the molecular formula of Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate?
The molecular formula of Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate is C22H26N2O4.
What is the molecular weight of Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate?
The molecular weight of Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate is 382.19 g/mol.
Where can I buy Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate?
You can request a quote for Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-{[3-(2-ethylbutanoylamino)phenyl]carbonylamino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.