![ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate structure](/static/products/799/799265-06-8.png)
ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate
TL;DR: ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate (CAS 799265-06-8) is a chemical compound with molecular formula C21H20N2O4 and molecular weight 364.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-(3-acetylindol-1-yl)acetyl]amino]benzoate
Also Known As: BAS 07217255, ethyl 4-(2-(3-acetyl-1H-indol-1-yl)acetamido)benzoate, ethyl 4-[[2-(3-acetylindol-1-yl)acetyl]amino]benzoate, ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate, 4-[2-(3-Acetyl-indol-1-yl)-acetylamino]-benzoic acid ethyl ester
| Molecular Formula | C21H20N2O4 |
|---|---|
| Molecular Weight | 364.14 g/mol |
| LogP | 3.6593 |
| Topological Polar Surface Area | 77.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 364.1423 |
| Heavy Atoms | 27 |
| Complexity | 1002.6984 |
Chemical Identifiers
| CAS Number | 799265-06-8 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=C(C3=CC=CC=C32)C(=O)C |
Product Overview
ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate (CAS 799265-06-8), with molecular formula C21H20N2O4 and molecular weight 364.14 g/mol. IUPAC: ethyl 4-[[2-(3-acetylindol-1-yl)acetyl]amino]benzoate.
Chemical Property Profile of ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate
Property Insights of ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate
The XLogP value of 3.6593 indicates that ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate. Following Lipinski's Rule of Five, ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate 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 ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate?
The CAS number of ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate is 799265-06-8.
What is the molecular formula of ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate?
The molecular formula of ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate is C21H20N2O4.
What is the molecular weight of ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate?
The molecular weight of ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate is 364.14 g/mol.
Where can I buy ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate?
You can request a quote for ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}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-acetyl-1H-indol-1-yl)acetyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-{[(3-acetyl-1H-indol-1-yl)acetyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.