![7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione structure](/static/products/847/847336-71-4.png)
7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione
TL;DR: 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione (CAS 847336-71-4) is a chemical compound with molecular formula C14H12N6S and molecular weight 296.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-(2,4-dimethylphenyl)-3,4,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,7,11-tetraene-5-thione
Also Known As: 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione, 7-(2,4-dimethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol
| Molecular Formula | C14H12N6S |
|---|---|
| Molecular Weight | 296.08 g/mol |
| LogP | 2.74263 |
| Topological Polar Surface Area | 63.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 296.0844 |
| Heavy Atoms | 21 |
| Complexity | 1038.6653 |
Chemical Identifiers
| CAS Number | 847336-71-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2C3=C(C=N2)C4=NNC(=S)N4C=N3)C |
Product Overview
7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione (CAS 847336-71-4), with molecular formula C14H12N6S and molecular weight 296.08 g/mol. IUPAC: 10-(2,4-dimethylphenyl)-3,4,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,7,11-tetraene-5-thione.
Chemical Property Profile of 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione
Property Insights of 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione
The XLogP value of 2.74263 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione. The TPSA of 63.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione. Following Lipinski's Rule of Five, 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione 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-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione?
The CAS number of 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione is 847336-71-4.
What is the molecular formula of 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione?
The molecular formula of 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione is C14H12N6S.
What is the molecular weight of 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione?
The molecular weight of 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione is 296.08 g/mol.
Where can I buy 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione?
You can request a quote for 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 7-(2,4-dimethylphenyl)-2,7-dihydro-3H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.