TL;DR: 2-Methoxy-4-(6-nitro-1H-benzo[D]imidazol-2-YL)phenol (CAS 108883-90-5) is a chemical compound with molecular formula C14H11N3O4 and molecular weight 285.07495 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methoxy-4-(6-nitro-1H-benzimidazol-2-yl)phenol
Also Known As: 2-METHOXY-4-(6-NITRO-1H-BENZO[D]IMIDAZOL-2-YL)PHENOL, 2-methoxy-4-(6-nitro-1H-benzimidazol-2-yl)phenol, 2-Methoxy-4-(5-nitro-1H-benzo[d]imidazol-2-yl)phenol, 2-methoxy-4-(6-nitrobenzimidazol-2-yl)phenol, AB00094570-01
| Molecular Formula | C14H11N3O4 |
| Molecular Weight | 285.07495 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.07495 Da |
| Heavy Atoms | 21 |
| Complexity | 389.0 |
| SMILES | COC1=C(C=CC(=C1)C2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])O |
| InChIKey | LSNPOGOZVAHETR-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxy-4-(6-nitro-1H-benzo[D]imidazol-2-YL)phenol. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methoxy-4-(6-nitro-1H-benzo[D]imidazol-2-YL)phenol. Following Lipinski's Rule of Five, 2-Methoxy-4-(6-nitro-1H-benzo[D]imidazol-2-YL)phenol has 2 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 2-Methoxy-4-(6-nitro-1H-benzo[D]imidazol-2-YL)phenol is 108883-90-5.
The molecular formula of 2-Methoxy-4-(6-nitro-1H-benzo[D]imidazol-2-YL)phenol is C14H11N3O4.
The molecular weight of 2-Methoxy-4-(6-nitro-1H-benzo[D]imidazol-2-YL)phenol is 285.07495 g/mol.
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