5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone
TL;DR: 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone (CAS 338398-23-5) is a chemical compound with molecular formula C13H12ClNO3S and molecular weight 297.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(benzenesulfonyl)-5-chloro-4,6-dimethyl-1H-pyridin-2-one
Also Known As: 5-chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone, 3-(benzenesulfonyl)-5-chloro-4,6-dimethyl-1H-pyridin-2-one, 3-(benzenesulfonyl)-5-chloro-4,6-dimethyl-1,2-dihydropyridin-2-one, 3-(Benzenesulfonyl)-5-chloro-4,6-dimethylpyridin-2(1H)-one, RefChem:302542
| Molecular Formula | C13H12ClNO3S |
|---|---|
| Molecular Weight | 297.02 g/mol |
| LogP | 2.47794 |
| Topological Polar Surface Area | 67.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 297.02264 |
| Heavy Atoms | 19 |
| Complexity | 779.5259 |
Chemical Identifiers
| CAS Number | 338398-23-5 |
|---|---|
| SMILES | CC1=C(C(=O)NC(=C1Cl)C)S(=O)(=O)C2=CC=CC=C2 |
Product Overview
5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone (CAS 338398-23-5), with molecular formula C13H12ClNO3S and molecular weight 297.02 g/mol. IUPAC: 3-(benzenesulfonyl)-5-chloro-4,6-dimethyl-1H-pyridin-2-one.
Chemical Property Profile of 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone
Property Insights of 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone
The XLogP value of 2.47794 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone. The TPSA of 67.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone. Following Lipinski's Rule of Five, 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone has 1 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 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone?
The CAS number of 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone is 338398-23-5.
What is the molecular formula of 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone?
The molecular formula of 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone is C13H12ClNO3S.
What is the molecular weight of 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone?
The molecular weight of 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone is 297.02 g/mol.
Where can I buy 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone?
You can request a quote for 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-4,6-dimethyl-3-(phenylsulfonyl)-2(1H)-pyridinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.