2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid
TL;DR: 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid (CAS 1021089-24-6) is a chemical compound with molecular formula C10H8Cl2N2O4S and molecular weight 321.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid
Also Known As: Maybridge1_007147, 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone, 1-(2',5'-Dichloro-4'-sulfophenyl)-3-methyl-5-pyrazolone, ALPHA-D-GLUCOPYRANOSEPENTABENZOATE, P084
| Molecular Formula | C10H8Cl2N2O4S |
|---|---|
| Molecular Weight | 321.96 g/mol |
| LogP | 2.02752 |
| Topological Polar Surface Area | 92.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 321.9582 |
| Heavy Atoms | 19 |
| Complexity | 807.42255 |
Chemical Identifiers
| CAS Number | 1021089-24-6 |
|---|---|
| SMILES | CC1=CC(=O)N(N1)C2=CC(=C(C=C2Cl)S(=O)(=O)O)Cl |
Product Overview
2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid (CAS 1021089-24-6), with molecular formula C10H8Cl2N2O4S and molecular weight 321.96 g/mol. IUPAC: 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid.
Chemical Property Profile of 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid
Property Insights of 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid
The XLogP value of 2.02752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid. The TPSA of 92.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid. Following Lipinski's Rule of Five, 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid has 2 hydrogen bond donor(s) and 3 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 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid?
The CAS number of 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid is 1021089-24-6.
What is the molecular formula of 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid?
The molecular formula of 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid is C10H8Cl2N2O4S.
What is the molecular weight of 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid?
The molecular weight of 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid is 321.96 g/mol.
Where can I buy 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid?
You can request a quote for 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic 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-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,5-dichloro-4-(5-methyl-3-oxo-1H-pyrazol-2-yl)benzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.