7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole
TL;DR: 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole (CAS 129485-68-3) is a chemical compound with molecular formula C8H6N4S and molecular weight 190.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-3H-imidazo[4,5-e][2,1,3]benzothiadiazole
Also Known As: 7-methyl-3H-imidazo[4,5-e][2,1,3]benzothiadiazole, 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole, 6H-Imidazo[4,5-e]-2,1,3-benzothiadiazole,7-methyl-(9CI), 7-methyl-1,2,5-thiadiazolo[3,4-g]benzimidazole, 7-Methyl-6H-imidazo[4,5-e][2,1,3]benzothiadiazole
| Molecular Formula | C8H6N4S |
|---|---|
| Molecular Weight | 190.03 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 74.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 190.03131 |
| Heavy Atoms | 13 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 129485-68-3 |
|---|---|
| SMILES | CC1=NC2=CC=C3C(=NSN3)C2=N1 |
| InChIKey | JCFCCRUIDFXCPY-UHFFFAOYSA-N |
Product Overview
7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole (CAS 129485-68-3), with molecular formula C8H6N4S and molecular weight 190.03 g/mol. IUPAC: 7-methyl-3H-imidazo[4,5-e][2,1,3]benzothiadiazole.
Chemical Property Profile of 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole
Property Insights of 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole. The TPSA of 74.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole. Following Lipinski's Rule of Five, 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole has 1 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 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole?
The CAS number of 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole is 129485-68-3.
What is the molecular formula of 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole?
The molecular formula of 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole is C8H6N4S.
What is the molecular weight of 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole?
The molecular weight of 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole is 190.03 g/mol.
Where can I buy 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole?
You can request a quote for 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 7-Methyl-8H-imidazo[4,5-E][2,1,3]benzothiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.