TL;DR: 1H-Indazol-1-amine, N-((5-nitro-2-furanyl)methylene)- (CAS 111042-00-3) is a chemical compound with molecular formula C12H8N4O3 and molecular weight 256.05963 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-N-indazol-1-yl-1-(5-nitrofuran-2-yl)methanimine
Also Known As: 1H-Indazol-1-amine, N-((5-nitro-2-furanyl)methylene)-, N-((5-Nitro-2-furanyl)methylene)-1H-indazol-1-amine, N-(1H-indazol-1-yl)-1-(5-nitrofuran-2-yl)methanimine, N-(1H-Indazol-1-yl)-alpha-(5-nitrofuran-2-yl)methanimine, (E)-N-(1H-Indazol-1-yl)-1-(5-nitrofuran-2-yl)methanimine
| Molecular Formula | C12H8N4O3 |
| Molecular Weight | 256.05963 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 89.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.05963 Da |
| Heavy Atoms | 19 |
| Complexity | 370.0 |
| SMILES | C1=CC=C2C(=C1)C=NN2/N=C/C3=CC=C(O3)[N+](=O)[O-] |
| InChIKey | HMFNOYATWYNTAK-RIYZIHGNSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indazol-1-amine, N-((5-nitro-2-furanyl)methylene)-. The TPSA of 89.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Indazol-1-amine, N-((5-nitro-2-furanyl)methylene)-. Following Lipinski's Rule of Five, 1H-Indazol-1-amine, N-((5-nitro-2-furanyl)methylene)- 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 1H-Indazol-1-amine, N-((5-nitro-2-furanyl)methylene)- is 111042-00-3.
The molecular formula of 1H-Indazol-1-amine, N-((5-nitro-2-furanyl)methylene)- is C12H8N4O3.
The molecular weight of 1H-Indazol-1-amine, N-((5-nitro-2-furanyl)methylene)- is 256.05963 g/mol.
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