TL;DR: 2,4'-Bi-1H-imidazole, 1,1'-dimethyl-2'-nitro- (CAS 141657-27-4) is a chemical compound with molecular formula C8H9N5O2 and molecular weight 207.07562 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-4-(1-methylimidazol-2-yl)-2-nitroimidazole
Also Known As: 2,4'-Bi-1H-imidazole, 1,1'-dimethyl-2'-nitro-, 1,1'-Dimethyl-2'-nitro-2,4'-Bi-1H-imidazole, 1-methyl-4-(1-methylimidazol-2-yl)-2-nitroimidazole, 1,1'-Dimethyl-2'-nitro-1H,1'H-2,4'-biimidazole
| Molecular Formula | C8H9N5O2 |
| Molecular Weight | 207.07562 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 81.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 207.07562 Da |
| Heavy Atoms | 15 |
| Complexity | 256.0 |
| SMILES | CN1C=CN=C1C2=CN(C(=N2)[N+](=O)[O-])C |
| InChIKey | JOXBNAFBSZBFRF-UHFFFAOYSA-N |
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4'-Bi-1H-imidazole, 1,1'-dimethyl-2'-nitro-. The TPSA of 81.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4'-Bi-1H-imidazole, 1,1'-dimethyl-2'-nitro-. Following Lipinski's Rule of Five, 2,4'-Bi-1H-imidazole, 1,1'-dimethyl-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 2,4'-Bi-1H-imidazole, 1,1'-dimethyl-2'-nitro- is 141657-27-4.
The molecular formula of 2,4'-Bi-1H-imidazole, 1,1'-dimethyl-2'-nitro- is C8H9N5O2.
The molecular weight of 2,4'-Bi-1H-imidazole, 1,1'-dimethyl-2'-nitro- is 207.07562 g/mol.
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