1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole
TL;DR: 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole (CAS 838844-74-9) is a chemical compound with molecular formula C17H18N2O3S and molecular weight 330.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-ethoxy-5-methylphenyl)sulfonyl-2-methylbenzimidazole
Also Known As: 1-(2-ethoxy-5-methylphenyl)sulfonyl-2-methylbenzimidazole, 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole, 1-[(2-ethoxy-5-methylphenyl)sulfonyl]-2-methylbenzimidazole, AP-263/42911199, ethyl 4-methyl-2-[(2-methyl-1H-benzimidazol-1-yl)sulfonyl]phenyl ether
| Molecular Formula | C17H18N2O3S |
|---|---|
| Molecular Weight | 330.10 g/mol |
| LogP | 3.28884 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.10382 |
| Heavy Atoms | 23 |
| Complexity | 974.6672 |
Chemical Identifiers
| CAS Number | 838844-74-9 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C)S(=O)(=O)N2C(=NC3=CC=CC=C32)C |
Product Overview
1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole (CAS 838844-74-9), with molecular formula C17H18N2O3S and molecular weight 330.10 g/mol. IUPAC: 1-(2-ethoxy-5-methylphenyl)sulfonyl-2-methylbenzimidazole.
Chemical Property Profile of 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole
Property Insights of 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole
The XLogP value of 3.28884 indicates that 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole. Following Lipinski's Rule of Five, 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole has 0 hydrogen bond donor(s) and 4 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-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole?
The CAS number of 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole is 838844-74-9.
What is the molecular formula of 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole?
The molecular formula of 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole is C17H18N2O3S.
What is the molecular weight of 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole?
The molecular weight of 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole is 330.10 g/mol.
Where can I buy 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole?
You can request a quote for 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-ethoxy-5-methylbenzenesulfonyl)-2-methyl-1H-1,3-benzodiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.