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Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate
TL;DR: Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate (CAS 518009-32-0) is a chemical compound with molecular formula C17H16ClNO4S and molecular weight 365.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-[[2-(4-chlorophenyl)sulfanylacetyl]amino]phenoxy]acetate
Also Known As: methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate, methyl 2-(4-(2-((4-chlorophenyl)thio)acetamido)phenoxy)acetate, methyl 2-[4-[[2-(4-chlorophenyl)sulfanylacetyl]amino]phenoxy]acetate
| Molecular Formula | C17H16ClNO4S |
|---|---|
| Molecular Weight | 365.05 g/mol |
| LogP | 3.6226 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 365.04886 |
| Heavy Atoms | 24 |
| Complexity | 688.74164 |
Chemical Identifiers
| CAS Number | 518009-32-0 |
|---|---|
| SMILES | COC(=O)COC1=CC=C(C=C1)NC(=O)CSC2=CC=C(C=C2)Cl |
Product Overview
Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate (CAS 518009-32-0), with molecular formula C17H16ClNO4S and molecular weight 365.05 g/mol. IUPAC: methyl 2-[4-[[2-(4-chlorophenyl)sulfanylacetyl]amino]phenoxy]acetate.
Chemical Property Profile of Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate
Property Insights of Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate
The XLogP value of 3.6226 indicates that Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate 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 [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate. Following Lipinski's Rule of Five, Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate has 1 hydrogen bond donor(s) and 5 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 [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate?
The CAS number of Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate is 518009-32-0.
What is the molecular formula of Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate?
The molecular formula of Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate is C17H16ClNO4S.
What is the molecular weight of Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate?
The molecular weight of Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate is 365.05 g/mol.
Where can I buy Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate?
You can request a quote for Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl [4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenoxy]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.