![4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione structure](/static/products/103/1035966-64-3.png)
4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione
TL;DR: 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione (CAS 1035966-64-3) is a chemical compound with molecular formula C12H12N6OS and molecular weight 288.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione
Also Known As: 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione, 4-{[1-(5-Methyl-furan-2-yl)-meth-(E)-ylidene]-amino}-5-(5-methyl-2H-pyrazol-3-yl)-4H-[1,2,4]triazole-3-thi ol, (E)-5-(3-methyl-1H-pyrazol-5-yl)-4-(((5-methylfuran-2-yl)methylene)amino)-4H-1,2,4-triazole-3-thiol, 4-[(1E)-2-(5-methyl(2-furyl))-1-azavinyl]-5-(3-methylpyrazol-5-yl)-1,2,4-triaz ole-3-thiol, 4-[(5-methyl-2-furanyl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione
| Molecular Formula | C12H12N6OS |
|---|---|
| Molecular Weight | 288.08 g/mol |
| LogP | 2.42283 |
| Topological Polar Surface Area | 87.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.0793 |
| Heavy Atoms | 20 |
| Complexity | 820.9875 |
Chemical Identifiers
| CAS Number | 1035966-64-3 |
|---|---|
| SMILES | CC1=CC=C(O1)/C=N/N2C(=NNC2=S)C3=NNC(=C3)C |
Product Overview
4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione (CAS 1035966-64-3), with molecular formula C12H12N6OS and molecular weight 288.08 g/mol. IUPAC: 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione
Property Insights of 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione
The XLogP value of 2.42283 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione. The TPSA of 87.79 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione. Following Lipinski's Rule of Five, 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione has 2 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 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione?
The CAS number of 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione is 1035966-64-3.
What is the molecular formula of 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione?
The molecular formula of 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione is C12H12N6OS.
What is the molecular weight of 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione?
The molecular weight of 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione is 288.08 g/mol.
Where can I buy 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione?
You can request a quote for 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-[(E)-(5-methylfuran-2-yl)methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.