2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid
TL;DR: 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid (CAS 40537-81-3) is a chemical compound with molecular formula C25H23Cl2N5O6S2 and molecular weight 623.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dichloro-4-[4-[[3-[ethyl(phenyl)sulfamoyl]-4-methylphenyl]diazenyl]-3-methyl-5-oxo-4H-pyrazol-1-yl]benzenesulfonic acid
Also Known As: 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid, 2,5-dichloro-4-[4-[[3-[ethyl(phenyl)sulfamoyl]-4-methylphenyl]diazenyl]-3-methyl-5-oxo-4H-pyrazol-1-yl]benzenesulfonic acid, Benzenesulfonic acid, 2,5-dichloro-4-(4-((3-((ethylphenylamino)sulfonyl)-4-methylphenyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-, Benzenesulfonic acid, 2,5-dichloro-4-[4-[[3-[(ethylphenylamino)sulfonyl]-4-methylphenyl]azo]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]-, 2,5-Dichloro-4-[[4-[3-(ethylphenylaminosulfonyl)-4-methylphenylazo]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol]-1-yl]benzenesulfonic acid
| Molecular Formula | C25H23Cl2N5O6S2 |
|---|---|
| Molecular Weight | 623.05 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 623.0467 |
| Heavy Atoms | 40 |
| Complexity | 1200.0 |
Chemical Identifiers
| CAS Number | 40537-81-3 |
|---|---|
| SMILES | CCN(C1=CC=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)N=NC3C(=NN(C3=O)C4=CC(=C(C=C4Cl)S(=O)(=O)O)Cl)C)C |
| InChIKey | WSQCBGZSSIUKQP-UHFFFAOYSA-N |
Product Overview
2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid (CAS 40537-81-3), with molecular formula C25H23Cl2N5O6S2 and molecular weight 623.05 g/mol. IUPAC: 2,5-dichloro-4-[4-[[3-[ethyl(phenyl)sulfamoyl]-4-methylphenyl]diazenyl]-3-methyl-5-oxo-4H-pyrazol-1-yl]benzenesulfonic acid.
Chemical Property Profile of 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid
Property Insights of 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid
The XLogP value of 4.8 indicates that 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 166.0 Ų indicates high polarity, suggesting 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid?
The CAS number of 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid is 40537-81-3.
What is the molecular formula of 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid?
The molecular formula of 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid is C25H23Cl2N5O6S2.
What is the molecular weight of 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid?
The molecular weight of 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid is 623.05 g/mol.
Where can I buy 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid?
You can request a quote for 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dichloro-4-(4-((3-((ethylphenylamino)sulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.