![1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene structure](/static/products/104/1042680-89-6.png)
1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene
TL;DR: 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene (CAS 1042680-89-6) is a chemical compound with molecular formula C15H14N6O2S and molecular weight 342.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3,4-dimethoxyphenyl)-3-(5-methyl-1H-pyrazol-3-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene, 5-[6-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]-3-methyl-1H-pyrazole, 6-(3,4-dimethoxyphenyl)-3-(3-methyl-1H-pyrazol-5-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-(3,4-dimethoxyphenyl)-3-(3-methyl-1H-pyrazol-5-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-(3,4-dimethoxyphenyl)-3-(5-methyl-1H-pyrazol-3-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C15H14N6O2S |
|---|---|
| Molecular Weight | 342.09 g/mol |
| LogP | 2.56852 |
| Topological Polar Surface Area | 90.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.0899 |
| Heavy Atoms | 24 |
| Complexity | 1018.2507 |
Chemical Identifiers
| CAS Number | 1042680-89-6 |
|---|---|
| SMILES | CC1=CC(=NN1)C2=NN=C3N2N=C(S3)C4=CC(=C(C=C4)OC)OC |
Product Overview
1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene (CAS 1042680-89-6), with molecular formula C15H14N6O2S and molecular weight 342.09 g/mol. IUPAC: 6-(3,4-dimethoxyphenyl)-3-(5-methyl-1H-pyrazol-3-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene
Property Insights of 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene
The XLogP value of 2.56852 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene. The TPSA of 90.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene. Following Lipinski's Rule of Five, 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene has 1 hydrogen bond donor(s) and 7 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-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene?
The CAS number of 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene is 1042680-89-6.
What is the molecular formula of 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene?
The molecular formula of 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene is C15H14N6O2S.
What is the molecular weight of 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene?
The molecular weight of 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene is 342.09 g/mol.
Where can I buy 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene?
You can request a quote for 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2-dimethoxy-4-[3-(3-methylpyrazol-5-yl)(1,2,4-triazolo[3,4-b]1,3,4-thiadiazo lin-6-yl)]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.