TL;DR: 1H-Imidazole-2-ethanol, 5-((3,5-dichlorophenyl)thio)-1-ethyl-4-(1-methylethyl)- (CAS 17990-64-6) is a chemical compound with molecular formula C16H20Cl2N2OS and molecular weight 358.06735 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[5-(3,5-dichlorophenyl)sulfanyl-1-ethyl-4-propan-2-ylimidazol-2-yl]ethanol
Also Known As: 1H-Imidazole-2-ethanol, 5-((3,5-dichlorophenyl)thio)-1-ethyl-4-(1-methylethyl)-, 2-{5-[(3,5-dichlorophenyl)sulfanyl]-1-ethyl-4-(1-methylethyl)-1h-imidazol-2-yl}ethanol, 1H-Imidazole-2-ethanol, 5-[(3,5-dichlorophenyl)thio]-1-ethyl-4-(1-methylethyl)-, 2-[5-(3,5-dichlorophenyl)sulfanyl-1-ethyl-4-isopropyl-imidazol-2-yl]ethanol, 2-[5-(3,5-dichlorophenyl)sulfanyl-1-ethyl-4-propan-2-ylimidazol-2-yl]ethanol
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H20Cl2N2OS |
| Molecular Weight | 358.06735 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 63.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.06735 Da |
| Heavy Atoms | 22 |
| Complexity | 338.0 |
| SMILES | CCN1C(=NC(=C1SC2=CC(=CC(=C2)Cl)Cl)C(C)C)CCO |
| InChIKey | MKLVKYVBEBBXTB-UHFFFAOYSA-N |
The XLogP value of 4.7 indicates that 1H-Imidazole-2-ethanol, 5-((3,5-dichlorophenyl)thio)-1-ethyl-4-(1-methylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Imidazole-2-ethanol, 5-((3,5-dichlorophenyl)thio)-1-ethyl-4-(1-methylethyl)-. Following Lipinski's Rule of Five, 1H-Imidazole-2-ethanol, 5-((3,5-dichlorophenyl)thio)-1-ethyl-4-(1-methylethyl)- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1H-Imidazole-2-ethanol, 5-((3,5-dichlorophenyl)thio)-1-ethyl-4-(1-methylethyl)- is 17990-64-6.
The molecular formula of 1H-Imidazole-2-ethanol, 5-((3,5-dichlorophenyl)thio)-1-ethyl-4-(1-methylethyl)- is C16H20Cl2N2OS.
The molecular weight of 1H-Imidazole-2-ethanol, 5-((3,5-dichlorophenyl)thio)-1-ethyl-4-(1-methylethyl)- is 358.06735 g/mol.
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