N1-Acetyl-N4-maleylsulfanilamide
TL;DR: N1-Acetyl-N4-maleylsulfanilamide (CAS 356567-68-5) is a chemical compound with molecular formula C12H12N2O6S and molecular weight 312.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(acetylsulfamoyl)anilino]-4-oxobut-2-enoic acid
Also Known As: N1-ACETYL-N4-MALEYLSULFANILAMIDE, 4-[4-(acetylsulfamoyl)anilino]-4-oxobut-2-enoic acid, 4-[4-(acetylsulfamoyl)anilino]-4-oxo-but-2-enoic acid, 4-{[4-(acetylsulfamoyl)phenyl]amino}-4-oxobut-2-enoic acid, (E)-4-((4-(N-acetylsulfamoyl)phenyl)amino)-4-oxobut-2-enoic acid
| Molecular Formula | C12H12N2O6S |
|---|---|
| Molecular Weight | 312.04 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.0416 |
| Heavy Atoms | 21 |
| Complexity | 541.0 |
Chemical Identifiers
| CAS Number | 356567-68-5 |
|---|---|
| SMILES | CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C=CC(=O)O |
| InChIKey | XNJBIHVSRVILJD-UHFFFAOYSA-N |
Product Overview
N1-Acetyl-N4-maleylsulfanilamide (CAS 356567-68-5), with molecular formula C12H12N2O6S and molecular weight 312.04 g/mol. IUPAC: 4-[4-(acetylsulfamoyl)anilino]-4-oxobut-2-enoic acid.
Chemical Property Profile of N1-Acetyl-N4-maleylsulfanilamide
Property Insights of N1-Acetyl-N4-maleylsulfanilamide
The XLogP value of -1.3 indicates that N1-Acetyl-N4-maleylsulfanilamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N1-Acetyl-N4-maleylsulfanilamide. Following Lipinski's Rule of Five, N1-Acetyl-N4-maleylsulfanilamide 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 N1-Acetyl-N4-maleylsulfanilamide?
The CAS number of N1-Acetyl-N4-maleylsulfanilamide is 356567-68-5.
What is the molecular formula of N1-Acetyl-N4-maleylsulfanilamide?
The molecular formula of N1-Acetyl-N4-maleylsulfanilamide is C12H12N2O6S.
What is the molecular weight of N1-Acetyl-N4-maleylsulfanilamide?
The molecular weight of N1-Acetyl-N4-maleylsulfanilamide is 312.04 g/mol.
Where can I buy N1-Acetyl-N4-maleylsulfanilamide?
You can request a quote for N1-Acetyl-N4-maleylsulfanilamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1-Acetyl-N4-maleylsulfanilamide?
Yes, KEHONG BIO provides custom synthesis services for N1-Acetyl-N4-maleylsulfanilamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.