1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole
TL;DR: 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole (CAS 111041-97-5) is a chemical compound with molecular formula C7H5N5O3 and molecular weight 207.03925 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(5-nitrofuran-2-yl)-N-(1,2,4-triazol-1-yl)methanimine
Also Known As: 1-NFMAT, 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole, 1-(5-nitrofuran-2-yl)-N-(1,2,4-triazol-1-yl)methanimine, 1H-1,2,4-Triazol-1-amine,N-[(5-nitro-2-furanyl)methylene]-, 1-(5-nitrofuran-2-yl)-N-(1H-1,2,4-triazol-1-yl)methanimine
Technical Specifications
| Molecular Formula | C7H5N5O3 |
| Molecular Weight | 207.03925 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.03925 Da |
| Heavy Atoms | 15 |
| Complexity | 266.0 |
| SMILES | C1=C(OC(=C1)[N+](=O)[O-])C=NN2C=NC=N2 |
| InChIKey | QNALNSKMFDNVKC-UHFFFAOYSA-N |
Chemical Property Profile of 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole
Property Insights of 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole. Following Lipinski's Rule of Five, 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole?
The CAS number of 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole is 111041-97-5.
What is the molecular formula of 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole?
The molecular formula of 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole is C7H5N5O3.
What is the molecular weight of 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole?
The molecular weight of 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole is 207.03925 g/mol.
Where can I buy 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole?
You can request a quote for 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole?
Yes, CoreyChem provides custom synthesis services for 1-(((5-Nitro-2-furyl)methylene)amino)-1,2,4-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.