![N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide structure](/static/products/2546/25462-26-4.webp)
N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide
TL;DR: N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide (CAS 25462-26-4) is a chemical compound with molecular formula C11H11Cl2NO3S and molecular weight 306.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2,2-dichloro-1-(4-methylphenyl)sulfonylethenyl]acetamide
Also Known As: BAS 00120114, 4-Amino-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one, N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide, n-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]ethenyl}acetamide, N-[2,2-Dichloro-1-(toluene-4-sulfonyl)-vinyl]-acetamide
| Molecular Formula | C11H11Cl2NO3S |
|---|---|
| Molecular Weight | 306.98 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 71.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.98367 |
| Heavy Atoms | 18 |
| Complexity | 441.0 |
Chemical Identifiers
| CAS Number | 25462-26-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C(=C(Cl)Cl)NC(=O)C |
| InChIKey | YRKXBIKDUWMGSO-UHFFFAOYSA-N |
Product Overview
N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide (CAS 25462-26-4), with molecular formula C11H11Cl2NO3S and molecular weight 306.98 g/mol. IUPAC: N-[2,2-dichloro-1-(4-methylphenyl)sulfonylethenyl]acetamide.
Chemical Property Profile of N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide
Property Insights of N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide. Following Lipinski's Rule of Five, N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide 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 N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide?
The CAS number of N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide is 25462-26-4.
What is the molecular formula of N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide?
The molecular formula of N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide is C11H11Cl2NO3S.
What is the molecular weight of N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide?
The molecular weight of N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide is 306.98 g/mol.
Where can I buy N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide?
You can request a quote for N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-{2,2-dichloro-1-[(4-methylphenyl)sulfonyl]vinyl}acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.