6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one
TL;DR: 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one (CAS 454181-45-4) is a chemical compound with molecular formula C10H7ClN2O3S and molecular weight 269.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chlorophenyl)sulfonyl-1H-pyridazin-6-one
Also Known As: Phenyl-Substituted Sulfonylpyridazinone, 8d, 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one, 6-(3-chlorophenyl)sulfonyl-2H-pyridazin-3-one, 6-((3-chlorophenyl)sulfonyl)pyridazin-3(6H)-one, 6-[(3-chlorobenzene)sulfonyl]-2,3-dihydropyridazin-3-one
| Molecular Formula | C10H7ClN2O3S |
|---|---|
| Molecular Weight | 269.99 g/mol |
| LogP | 1.2561 |
| Topological Polar Surface Area | 79.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 269.9866 |
| Heavy Atoms | 17 |
| Complexity | 688.99097 |
Chemical Identifiers
| CAS Number | 454181-45-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)S(=O)(=O)C2=NNC(=O)C=C2 |
Product Overview
6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one (CAS 454181-45-4), with molecular formula C10H7ClN2O3S and molecular weight 269.99 g/mol. IUPAC: 3-(3-chlorophenyl)sulfonyl-1H-pyridazin-6-one.
Chemical Property Profile of 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one
Property Insights of 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one
The XLogP value of 1.2561 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one. The TPSA of 79.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one. Following Lipinski's Rule of Five, 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one has 1 hydrogen bond donor(s) and 4 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 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one?
The CAS number of 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one is 454181-45-4.
What is the molecular formula of 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one?
The molecular formula of 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one is C10H7ClN2O3S.
What is the molecular weight of 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one?
The molecular weight of 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one is 269.99 g/mol.
Where can I buy 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one?
You can request a quote for 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one?
Yes, KEHONG BIO provides custom synthesis services for 6-(3-Chloro-benzenesulfonyl)-2H-pyridazin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.