1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole
TL;DR: 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole (CAS 313233-70-4) is a chemical compound with molecular formula C12H14N2O4S and molecular weight 282.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dimethoxyphenyl)sulfonyl-4-methylimidazole
Also Known As: 1-(3,4-dimethoxyphenyl)sulfonyl-4-methylimidazole, BIM-0005628.P001, 1-[(3,4-dimethoxyphenyl)sulfonyl]-4-methylimidazole, 1-(3,4-dimethoxybenzenesulfonyl)-4-methyl-1H-imidazole, 1-{[3,4-bis(methyloxy)phenyl]sulfonyl}-4-methyl-1H-imidazole
| Molecular Formula | C12H14N2O4S |
|---|---|
| Molecular Weight | 282.07 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 78.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.0674 |
| Heavy Atoms | 19 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 313233-70-4 |
|---|---|
| SMILES | CC1=CN(C=N1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC |
| InChIKey | NBKJTBNZPFOWDW-UHFFFAOYSA-N |
Product Overview
1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole (CAS 313233-70-4), with molecular formula C12H14N2O4S and molecular weight 282.07 g/mol. IUPAC: 1-(3,4-dimethoxyphenyl)sulfonyl-4-methylimidazole.
Chemical Property Profile of 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole
Property Insights of 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole. Following Lipinski's Rule of Five, 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole has 0 hydrogen bond donor(s) and 5 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 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole?
The CAS number of 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole is 313233-70-4.
What is the molecular formula of 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole?
The molecular formula of 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole is C12H14N2O4S.
What is the molecular weight of 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole?
The molecular weight of 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole is 282.07 g/mol.
Where can I buy 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole?
You can request a quote for 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dimethoxyphenyl)sulfonyl-4-methylimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.