![3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone structure](/static/products/4778/477864-56-5.webp)
3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone
TL;DR: 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone (CAS 477864-56-5) is a chemical compound with molecular formula C16H14ClNO3S and molecular weight 335.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)sulfonyl-4,6-dimethyl-1-prop-2-ynylpyridin-2-one
Also Known As: 1H-314S, 3-(4-chlorophenyl)sulfonyl-4,6-dimethyl-1-prop-2-ynylpyridin-2-one, 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone, 3-(4-chlorobenzenesulfonyl)-4,6-dimethyl-1-(prop-2-yn-1-yl)-1,2-dihydropyridin-2-one
| Molecular Formula | C16H14ClNO3S |
|---|---|
| Molecular Weight | 335.04 g/mol |
| LogP | 2.58454 |
| Topological Polar Surface Area | 56.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 335.0383 |
| Heavy Atoms | 22 |
| Complexity | 919.58887 |
Chemical Identifiers
| CAS Number | 477864-56-5 |
|---|---|
| SMILES | CC1=CC(=C(C(=O)N1CC#C)S(=O)(=O)C2=CC=C(C=C2)Cl)C |
Product Overview
3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone (CAS 477864-56-5), with molecular formula C16H14ClNO3S and molecular weight 335.04 g/mol. IUPAC: 3-(4-chlorophenyl)sulfonyl-4,6-dimethyl-1-prop-2-ynylpyridin-2-one.
Chemical Property Profile of 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone
Property Insights of 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone
The XLogP value of 2.58454 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone. With a topological polar surface area (TPSA) of 56.14 Ų, 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone 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 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone?
The CAS number of 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone is 477864-56-5.
What is the molecular formula of 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone?
The molecular formula of 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone is C16H14ClNO3S.
What is the molecular weight of 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone?
The molecular weight of 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone is 335.04 g/mol.
Where can I buy 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone?
You can request a quote for 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-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 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-chlorophenyl)sulfonyl]-4,6-dimethyl-1-(2-propynyl)-2(1H)-pyridinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.