4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid
TL;DR: 4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid (CAS 315672-91-4) is a chemical compound with molecular formula C14H16N2O6S and molecular weight 340.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid
Also Known As: BAS 09621560, 4-(4-morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid, (E)-4-[4-(4-Morpholinylsulfonyl)anilino]-4-oxo-2-butenoic acid, 4-{[4-(4-morpholinylsulfonyl)phenyl]amino}-4-oxo-2-butenoic acid
| Molecular Formula | C14H16N2O6S |
|---|---|
| Molecular Weight | 340.07 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.0729 |
| Heavy Atoms | 23 |
| Complexity | 554.0 |
Chemical Identifiers
| CAS Number | 315672-91-4 |
|---|---|
| SMILES | C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C=CC(=O)O |
| InChIKey | FCZQPDJNVDOUNL-UHFFFAOYSA-N |
Product Overview
4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid (CAS 315672-91-4), with molecular formula C14H16N2O6S and molecular weight 340.07 g/mol. IUPAC: 4-(4-morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid.
Chemical Property Profile of 4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid
Property Insights of 4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid
The XLogP value of -0.4 indicates that 4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid. Following Lipinski's Rule of Five, 4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid has 2 hydrogen bond donor(s) and 7 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-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid?
The CAS number of 4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid is 315672-91-4.
What is the molecular formula of 4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid?
The molecular formula of 4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid is C14H16N2O6S.
What is the molecular weight of 4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid?
The molecular weight of 4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid is 340.07 g/mol.
Where can I buy 4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid?
You can request a quote for 4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Morpholin-4-ylsulfonylanilino)-4-oxobut-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.