TL;DR: (1-((5-Nitrofurfurylidene)amino)pyrazole) (CAS 111070-55-4) is a chemical compound with molecular formula C8H6N4O3 and molecular weight 206.04399 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-(5-nitrofuran-2-yl)-N-pyrazol-1-ylmethanimine
Also Known As: (1-((5-Nitrofurfurylidene)amino)pyrazole), 1H-Pyrazol-1-amine, N-((5-nitro-2-furanyl)methylene)-, N-((5-Nitro-2-furanyl)methylene)-1H-pyrazol-1-amine, 1-(5-nitrofuran-2-yl)-N-pyrazol-1-ylmethanimine, N-(1H-Pyrazol-1-yl)-alpha-(5-nitrofuran-2-yl)methanimine
| Molecular Formula | C8H6N4O3 |
| Molecular Weight | 206.04399 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 89.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.04399 Da |
| Heavy Atoms | 15 |
| Complexity | 265.0 |
| SMILES | C1=CN(N=C1)/N=C/C2=CC=C(O2)[N+](=O)[O-] |
| InChIKey | DQXWSAXEIGMNAX-UXBLZVDNSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-((5-Nitrofurfurylidene)amino)pyrazole). The TPSA of 89.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (1-((5-Nitrofurfurylidene)amino)pyrazole). Following Lipinski's Rule of Five, (1-((5-Nitrofurfurylidene)amino)pyrazole) has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (1-((5-Nitrofurfurylidene)amino)pyrazole) is 111070-55-4.
The molecular formula of (1-((5-Nitrofurfurylidene)amino)pyrazole) is C8H6N4O3.
The molecular weight of (1-((5-Nitrofurfurylidene)amino)pyrazole) is 206.04399 g/mol.
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