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Methyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate
TL;DR: Methyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate (CAS 349575-70-8) is a chemical compound with molecular formula C17H17NO4S and molecular weight 331.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(2-methoxy-4-methylsulfanylbenzoyl)amino]benzoate
Also Known As: methyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate, methyl 2-(2-methoxy-4-(methylthio)benzamido)benzoate, methyl 2-[(2-methoxy-4-methylsulfanylbenzoyl)amino]benzoate, methyl 2-[(2-methoxy-4-methylthiophenyl)carbonylamino]benzoate, methyl 2-({[2-methoxy-4-(methylsulfanyl)phenyl]carbonyl}amino)benzoate
| Molecular Formula | C17H17NO4S |
|---|---|
| Molecular Weight | 331.09 g/mol |
| LogP | 3.456 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.08783 |
| Heavy Atoms | 23 |
| Complexity | 730.2833 |
Chemical Identifiers
| CAS Number | 349575-70-8 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)SC)C(=O)NC2=CC=CC=C2C(=O)OC |
Product Overview
Methyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate (CAS 349575-70-8), with molecular formula C17H17NO4S and molecular weight 331.09 g/mol. IUPAC: methyl 2-[(2-methoxy-4-methylsulfanylbenzoyl)amino]benzoate.
Chemical Property Profile of Methyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate
Property Insights of Methyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate
The XLogP value of 3.456 indicates that Methyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]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-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate. Following Lipinski's Rule of Five, Methyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate 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 2-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate?
The CAS number of Methyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate is 349575-70-8.
What is the molecular formula of Methyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate?
The molecular formula of Methyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate is C17H17NO4S.
What is the molecular weight of Methyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate?
The molecular weight of Methyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate is 331.09 g/mol.
Where can I buy Methyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate?
You can request a quote for Methyl 2-[2-methoxy-4-(methylsulfanyl)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-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[2-methoxy-4-(methylsulfanyl)benzamido]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.