methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate
TL;DR: methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate (CAS 832681-18-2) is a chemical compound with molecular formula C24H21ClN2O4S and molecular weight 468.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[4-[[2-[(2-chlorophenyl)methylsulfanyl]acetyl]amino]benzoyl]amino]benzoate
Also Known As: methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate, Methyl 2-[[4-[[2-[(2-chlorophenyl)methylsulfanyl]acetyl]amino]benzoyl]amino]benzoate, methyl 2-({[4-({[(2-chlorobenzyl)sulfanyl]acetyl}amino)phenyl]carbonyl}amino)benzoate
| Molecular Formula | C24H21ClN2O4S |
|---|---|
| Molecular Weight | 468.09 g/mol |
| LogP | 5.2508 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 468.09106 |
| Heavy Atoms | 32 |
| Complexity | 1118.992 |
Chemical Identifiers
| CAS Number | 832681-18-2 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)CSCC3=CC=CC=C3Cl |
Product Overview
methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate (CAS 832681-18-2), with molecular formula C24H21ClN2O4S and molecular weight 468.09 g/mol. IUPAC: methyl 2-[[4-[[2-[(2-chlorophenyl)methylsulfanyl]acetyl]amino]benzoyl]amino]benzoate.
Chemical Property Profile of methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate
Property Insights of methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate
The XLogP value of 5.2508 indicates that methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)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 methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate. Following Lipinski's Rule of Five, methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate?
The CAS number of methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate is 832681-18-2.
What is the molecular formula of methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate?
The molecular formula of methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate is C24H21ClN2O4S.
What is the molecular weight of methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate?
The molecular weight of methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate is 468.09 g/mol.
Where can I buy methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate?
You can request a quote for methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)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-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-(4-(2-((2-chlorobenzyl)thio)acetamido)benzamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.