![Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide structure](/static/products/811/81167-79-5.png)
Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide
TL;DR: Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide (CAS 81167-79-5) 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.
2-[(4-chlorophenyl)methylsulfonyl]-4-methyl-1-oxidopyridin-1-ium
Also Known As: Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide, 2-[(4-chlorophenyl)methylsulfonyl]-4-methyl-1-oxidopyridin-1-ium, 2-(4-Chloro-phenylmethanesulfonyl)-4-methyl-pyridine, 1-oxide, 2-(4-Chloro-phenylmethanesulfonyl)-4-methyl-pyridine,1-oxide, 2-[(4-chlorophenyl)methylsulfonyl]-4-methyl-1-oxido-pyridin-1-ium
| Molecular Formula | C13H12ClNO3S |
|---|---|
| Molecular Weight | 297.02 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 68.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.02264 |
| Heavy Atoms | 19 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 81167-79-5 |
|---|---|
| SMILES | CC1=CC(=[N+](C=C1)[O-])S(=O)(=O)CC2=CC=C(C=C2)Cl |
| InChIKey | OKWZGRWLYLJIEN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide (CAS 81167-79-5), with molecular formula C13H12ClNO3S and molecular weight 297.02 g/mol. IUPAC: 2-[(4-chlorophenyl)methylsulfonyl]-4-methyl-1-oxidopyridin-1-ium.
Chemical Property Profile of Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide
Property Insights of Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide. The TPSA of 68.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide. Following Lipinski's Rule of Five, Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide has 0 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 Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide?
The CAS number of Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide is 81167-79-5.
What is the molecular formula of Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide?
The molecular formula of Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide is C13H12ClNO3S.
What is the molecular weight of Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide?
The molecular weight of Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide is 297.02 g/mol.
Where can I buy Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide?
You can request a quote for Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for Pyridine, 2-[[(4-chlorophenyl)methyl]sulfonyl]-4-methyl-, 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.