![Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate structure](/static/products/593/593237-13-9.png)
Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate
TL;DR: Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate (CAS 593237-13-9) is a chemical compound with molecular formula C21H19ClN2O4 and molecular weight 398.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate
Also Known As: Methyl 2-chloro-5-[[2-(7-ethyl-3-formyl-indol-1-yl)acetyl]amino]benzoate, methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate, Methyl 2-chloro-5-{[(7-ethyl-3-formyl-1H-indol-1-yl)acetyl]amino}benzoate, Benzoic acid, 2-chloro-5-[[(7-ethyl-3-formyl-1H-indol-1-yl)acetyl]amino]-, methyl ester (9CI)
| Molecular Formula | C21H19ClN2O4 |
|---|---|
| Molecular Weight | 398.10 g/mol |
| LogP | 4.0949 |
| Topological Polar Surface Area | 77.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.10333 |
| Heavy Atoms | 28 |
| Complexity | 1071.698 |
Chemical Identifiers
| CAS Number | 593237-13-9 |
|---|---|
| SMILES | CCC1=C2C(=CC=C1)C(=CN2CC(=O)NC3=CC(=C(C=C3)Cl)C(=O)OC)C=O |
Product Overview
Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate (CAS 593237-13-9), with molecular formula C21H19ClN2O4 and molecular weight 398.10 g/mol. IUPAC: methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate.
Chemical Property Profile of Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate
Property Insights of Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate
The XLogP value of 4.0949 indicates that Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-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 Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate. Following Lipinski's Rule of Five, Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-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 Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate?
The CAS number of Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate is 593237-13-9.
What is the molecular formula of Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate?
The molecular formula of Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate is C21H19ClN2O4.
What is the molecular weight of Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate?
The molecular weight of Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate is 398.10 g/mol.
Where can I buy Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate?
You can request a quote for Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-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 Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-chloro-5-[[2-(7-ethyl-3-formylindol-1-yl)acetyl]amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.