TL;DR: 2,6,7-Trichloro-1H-benzo[d]imidazole (CAS 142356-71-6) is a chemical compound with molecular formula C7H3Cl3N2 and molecular weight 219.93619 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4,5-trichloro-1H-benzimidazole
Also Known As: 2,6,7-Trichloro-1H-benzo[d]imidazole, 2,4,5-trichloro-1H-benzimidazole, 2,4,5-Trichlorobenzimidazole, 2,6,7-Trichloro-1H-benzimidazole, 1H-Benzimidazole,2,6,7-trichloro-
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H3Cl3N2 |
| Molecular Weight | 219.93619 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 219.93619 Da |
| Heavy Atoms | 12 |
| Complexity | 178.0 |
| SMILES | C1=CC(=C(C2=C1NC(=N2)Cl)Cl)Cl |
| InChIKey | VJOBUHVWRUAKPS-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that 2,6,7-Trichloro-1H-benzo[d]imidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.7 Ų, 2,6,7-Trichloro-1H-benzo[d]imidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6,7-Trichloro-1H-benzo[d]imidazole has 1 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 2,6,7-Trichloro-1H-benzo[d]imidazole is 142356-71-6.
The molecular formula of 2,6,7-Trichloro-1H-benzo[d]imidazole is C7H3Cl3N2.
The molecular weight of 2,6,7-Trichloro-1H-benzo[d]imidazole is 219.93619 g/mol.
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