![3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide structure](/static/products/833/833443-79-1.png)
3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide
TL;DR: 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide (CAS 833443-79-1) is a chemical compound with molecular formula C16H16ClN3O4S2 and molecular weight 413.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide
Also Known As: 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide, AP-970/43373846, 4-({[(3-chloro-4-ethoxybenzoyl)amino]carbothioyl}amino)benzenesulfonamide
| Molecular Formula | C16H16ClN3O4S2 |
|---|---|
| Molecular Weight | 413.03 g/mol |
| LogP | 2.5129 |
| Topological Polar Surface Area | 110.52 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.02707 |
| Heavy Atoms | 26 |
| Complexity | 931.0111 |
Chemical Identifiers
| CAS Number | 833443-79-1 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N)Cl |
Product Overview
3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide (CAS 833443-79-1), with molecular formula C16H16ClN3O4S2 and molecular weight 413.03 g/mol. IUPAC: 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide.
Chemical Property Profile of 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide
Property Insights of 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide
The XLogP value of 2.5129 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide. The TPSA of 110.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide. Following Lipinski's Rule of Five, 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide has 3 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 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide?
The CAS number of 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide is 833443-79-1.
What is the molecular formula of 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide?
The molecular formula of 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide is C16H16ClN3O4S2.
What is the molecular weight of 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide?
The molecular weight of 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide is 413.03 g/mol.
Where can I buy 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide?
You can request a quote for 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-4-ethoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.