4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid
TL;DR: 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid (CAS 532408-48-3) is a chemical compound with molecular formula C18H18N2O6S and molecular weight 390.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-3-[[2-(4-methoxyphenoxy)acetyl]carbamothioylamino]benzoic acid
Also Known As: 4-methoxy-3-(3-(2-(4-methoxyphenoxy)acetyl)thioureido)benzoic acid, 4-methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid, 4-methoxy-3-[[2-(4-methoxyphenoxy)acetyl]carbamothioylamino]benzoic acid, 4-methoxy-3-[[2-(4-methoxyphenoxy)acetyl]thiocarbamoylamino]benzoic Acid
| Molecular Formula | C18H18N2O6S |
|---|---|
| Molecular Weight | 390.09 g/mol |
| LogP | 2.294 |
| Topological Polar Surface Area | 106.12 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 390.08856 |
| Heavy Atoms | 27 |
| Complexity | 838.24554 |
Chemical Identifiers
| CAS Number | 532408-48-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=C(C=CC(=C2)C(=O)O)OC |
Product Overview
4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid (CAS 532408-48-3), with molecular formula C18H18N2O6S and molecular weight 390.09 g/mol. IUPAC: 4-methoxy-3-[[2-(4-methoxyphenoxy)acetyl]carbamothioylamino]benzoic acid.
Chemical Property Profile of 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid
Property Insights of 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid
The XLogP value of 2.294 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid. The TPSA of 106.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid. Following Lipinski's Rule of Five, 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid has 3 hydrogen bond donor(s) and 6 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 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid?
The CAS number of 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid is 532408-48-3.
What is the molecular formula of 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid?
The molecular formula of 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid is C18H18N2O6S.
What is the molecular weight of 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid?
The molecular weight of 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid is 390.09 g/mol.
Where can I buy 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid?
You can request a quote for 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-3-({[(4-methoxyphenoxy)acetyl]carbamothioyl}amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.