3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid
TL;DR: 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid (CAS 94133-74-1) is a chemical compound with molecular formula C16H16N2O6S and molecular weight 364.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[3-(3-aminophenyl)-3-oxopropanoyl]amino]-4-methoxybenzenesulfonic acid
Also Known As: EINECS 302-737-6, 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid, 3-[[3-(3-AMINOPHENYL)-1,3-DIOXOPROPYL]AMINO]-4-METHOXYBENZENESULFONIC ACID, 3-[[3- -1,3-dioxopropyl]amino]-4-methoxybenzenesulphonicacid, 3-[3-(3-aminophenyl)-3-oxopropanamido]-4-methoxybenzene-1-sulfonic acid
| Molecular Formula | C16H16N2O6S |
|---|---|
| Molecular Weight | 364.07 g/mol |
| LogP | 1.7356 |
| Topological Polar Surface Area | 135.79 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 364.0729 |
| Heavy Atoms | 25 |
| Complexity | 923.9722 |
Chemical Identifiers
| CAS Number | 94133-74-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)S(=O)(=O)O)NC(=O)CC(=O)C2=CC(=CC=C2)N |
Product Overview
3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid (CAS 94133-74-1), with molecular formula C16H16N2O6S and molecular weight 364.07 g/mol. IUPAC: 3-[[3-(3-aminophenyl)-3-oxopropanoyl]amino]-4-methoxybenzenesulfonic acid.
Chemical Property Profile of 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid
Property Insights of 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid
The XLogP value of 1.7356 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid. The TPSA of 135.79 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid. Following Lipinski's Rule of Five, 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic 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 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid?
The CAS number of 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid is 94133-74-1.
What is the molecular formula of 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid?
The molecular formula of 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid is C16H16N2O6S.
What is the molecular weight of 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid?
The molecular weight of 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid is 364.07 g/mol.
Where can I buy 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid?
You can request a quote for 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-((3-(3-Aminophenyl)-1,3-dioxopropyl)amino)-4-methoxybenzenesulphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.