TL;DR: 1-Butyl-5,6-dimethyl-1H-benzimidazole (CAS 141211-34-9) is a chemical compound with molecular formula C13H18N2 and molecular weight 202.147 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-butyl-5,6-dimethylbenzimidazole
Also Known As: 1-butyl-5,6-dimethyl-1H-benzimidazole, 1-butyl-5,6-dimethylbenzimidazole, 1-butyl-5,6-dimethyl-benzoimidazole, 1H-Benzimidazole, 1-butyl-5,6-dimethyl-, 1-butyl-5,6-dimethyl-1H-1,3-benzodiazole
| Molecular Formula | C13H18N2 |
| Molecular Weight | 202.147 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.147 Da |
| Heavy Atoms | 15 |
| Complexity | 205.0 |
| SMILES | CCCCN1C=NC2=C1C=C(C(=C2)C)C |
| InChIKey | LHFOMDUUSOWVPJ-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that 1-Butyl-5,6-dimethyl-1H-benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.8 Ų, 1-Butyl-5,6-dimethyl-1H-benzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butyl-5,6-dimethyl-1H-benzimidazole has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Butyl-5,6-dimethyl-1H-benzimidazole is 141211-34-9.
The molecular formula of 1-Butyl-5,6-dimethyl-1H-benzimidazole is C13H18N2.
The molecular weight of 1-Butyl-5,6-dimethyl-1H-benzimidazole is 202.147 g/mol.
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