TL;DR: Imidazole, 5-chloro-1-isobutyl-2-isopropyl- (CAS 14040-88-1) is a chemical compound with molecular formula C10H17ClN2 and molecular weight 200.10803 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-chloro-1-(2-methylpropyl)-2-propan-2-ylimidazole
Also Known As: Imidazole, 5-chloro-1-isobutyl-2-isopropyl-, 5-Chloro-1-isobutyl-2-isopropylimidazole, 5-23-05-00207 (Beilstein Handbook Reference), 5-Chloro-1-isobutyl-2-isopropyl-1H-imidazole, 5-chloro-1-(2-methylpropyl)-2-(propan-2-yl)-1H-imidazole
| Molecular Formula | C10H17ClN2 |
| Molecular Weight | 200.10803 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 | 200.10803 Da |
| Heavy Atoms | 13 |
| Complexity | 159.0 |
| SMILES | CC(C)CN1C(=CN=C1C(C)C)Cl |
| InChIKey | FBAUXGDXYHQKES-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that Imidazole, 5-chloro-1-isobutyl-2-isopropyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.8 Ų, Imidazole, 5-chloro-1-isobutyl-2-isopropyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Imidazole, 5-chloro-1-isobutyl-2-isopropyl- 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 Imidazole, 5-chloro-1-isobutyl-2-isopropyl- is 14040-88-1.
The molecular formula of Imidazole, 5-chloro-1-isobutyl-2-isopropyl- is C10H17ClN2.
The molecular weight of Imidazole, 5-chloro-1-isobutyl-2-isopropyl- is 200.10803 g/mol.
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