![4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide structure](/static/products/791/791791-45-2.png)
4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide
TL;DR: 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide (CAS 791791-45-2) is a chemical compound with molecular formula C21H20ClN3O3S and molecular weight 429.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chlorophenyl)-3-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]urea
Also Known As: AN-329/42548525, 1-(3-chlorophenyl)-3-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]urea, 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide, 4-({[(3-chlorophenyl)amino]carbonyl}amino)-N-(3,5-dimethylphenyl)benzenesulfonamide, 4-{[(3-chlorophenyl)carbamoyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide
| Molecular Formula | C21H20ClN3O3S |
|---|---|
| Molecular Weight | 429.09 g/mol |
| LogP | 5.40164 |
| Topological Polar Surface Area | 87.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 429.0914 |
| Heavy Atoms | 29 |
| Complexity | 1125.8379 |
Chemical Identifiers
| CAS Number | 791791-45-2 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)NC3=CC(=CC=C3)Cl)C |
Product Overview
4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide (CAS 791791-45-2), with molecular formula C21H20ClN3O3S and molecular weight 429.09 g/mol. IUPAC: 1-(3-chlorophenyl)-3-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]urea.
Chemical Property Profile of 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide
Property Insights of 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide
The XLogP value of 5.40164 indicates that 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide. Following Lipinski's Rule of Five, 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide?
The CAS number of 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide is 791791-45-2.
What is the molecular formula of 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide?
The molecular formula of 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide is C21H20ClN3O3S.
What is the molecular weight of 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide?
The molecular weight of 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide is 429.09 g/mol.
Where can I buy 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide?
You can request a quote for 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(3-chloroanilino)carbonyl]amino}-N-(3,5-dimethylphenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.