TL;DR: 4-(4-Bromophenyl)-1H-imidazole (CAS 135991-95-6) is a chemical compound with molecular formula C9H7BrN2 and molecular weight 221.97926 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(4-bromophenyl)-1H-imidazole
Also Known As: 4-(4-Bromophenyl)-1H-imidazole, 5-(4-bromophenyl)-1H-imidazole, 4-(4-BROMO-PHENYL)-1H-IMIDAZOLE, CYP144A1 ligand, 4, 4-(4-bromophenyl)imidazole
| Molecular Formula | C9H7BrN2 |
| Molecular Weight | 221.97926 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.97926 Da |
| Heavy Atoms | 12 |
| Complexity | 143.0 |
| SMILES | C1=CC(=CC=C1C2=CN=CN2)Br |
| InChIKey | YLIOAWKNPLJMID-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Bromophenyl)-1H-imidazole. With a topological polar surface area (TPSA) of 28.7 Ų, 4-(4-Bromophenyl)-1H-imidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Bromophenyl)-1H-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 4-(4-Bromophenyl)-1H-imidazole is 135991-95-6.
The molecular formula of 4-(4-Bromophenyl)-1H-imidazole is C9H7BrN2.
The molecular weight of 4-(4-Bromophenyl)-1H-imidazole is 221.97926 g/mol.
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