TL;DR: 1H-Imidazo(4,5-f)quinoline, 1-methyl-2-nitro- (CAS 114451-09-1) is a chemical compound with molecular formula C11H8N4O2 and molecular weight 228.06473 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-2-nitroimidazo[4,5-f]quinoline
Also Known As: 1-Methyl-2-nitroimidazo(4,5-f)quinoline, 1H-Imidazo(4,5-f)quinoline, 1-methyl-2-nitro-, 1-methyl-2-nitroimidazo[4,5-f]quinoline, 1-methyl-2-nitro-1H-imidazo[4,5-f]quinoline
| Molecular Formula | C11H8N4O2 |
| Molecular Weight | 228.06473 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 76.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 228.06473 Da |
| Heavy Atoms | 17 |
| Complexity | 319.0 |
| SMILES | CN1C2=C(C=CC3=C2C=CC=N3)N=C1[N+](=O)[O-] |
| InChIKey | XBBLOAZAZIMFDM-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Imidazo(4,5-f)quinoline, 1-methyl-2-nitro-. The TPSA of 76.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Imidazo(4,5-f)quinoline, 1-methyl-2-nitro-. Following Lipinski's Rule of Five, 1H-Imidazo(4,5-f)quinoline, 1-methyl-2-nitro- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1H-Imidazo(4,5-f)quinoline, 1-methyl-2-nitro- is 114451-09-1.
The molecular formula of 1H-Imidazo(4,5-f)quinoline, 1-methyl-2-nitro- is C11H8N4O2.
The molecular weight of 1H-Imidazo(4,5-f)quinoline, 1-methyl-2-nitro- is 228.06473 g/mol.
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