![Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate structure](/static/products/6945/694507-45-4.webp)
Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate
TL;DR: Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate (CAS 694507-45-4) is a chemical compound with molecular formula C17H14Cl3NO4 and molecular weight 401.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-chloro-5-[2-(2,4-dichlorophenoxy)propanoylamino]benzoate
Also Known As: methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate, methyl 2-chloro-5-(2-(2,4-dichlorophenoxy)propanamido)benzoate, methyl 2-chloro-5-[2-(2,4-dichlorophenoxy)propanoylamino]benzoate
| Molecular Formula | C17H14Cl3NO4 |
|---|---|
| Molecular Weight | 401.00 g/mol |
| LogP | 4.8394 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 400.99884 |
| Heavy Atoms | 25 |
| Complexity | 810.4751 |
Chemical Identifiers
| CAS Number | 694507-45-4 |
|---|---|
| SMILES | CC(C(=O)NC1=CC(=C(C=C1)Cl)C(=O)OC)OC2=C(C=C(C=C2)Cl)Cl |
Product Overview
Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate (CAS 694507-45-4), with molecular formula C17H14Cl3NO4 and molecular weight 401.00 g/mol. IUPAC: methyl 2-chloro-5-[2-(2,4-dichlorophenoxy)propanoylamino]benzoate.
Chemical Property Profile of Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate
Property Insights of Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate
The XLogP value of 4.8394 indicates that Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate. Following Lipinski's Rule of Five, Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]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-(2,4-dichlorophenoxy)propanoyl]amino}benzoate?
The CAS number of Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate is 694507-45-4.
What is the molecular formula of Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate?
The molecular formula of Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate is C17H14Cl3NO4.
What is the molecular weight of Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate?
The molecular weight of Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate is 401.00 g/mol.
Where can I buy Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate?
You can request a quote for Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]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-(2,4-dichlorophenoxy)propanoyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-chloro-5-{[2-(2,4-dichlorophenoxy)propanoyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.