TL;DR: 2-((1-Benzoyl-5-phenyl-1H-imidazol-2-yl)thio)-N-(2,6-dimethylphenyl)acetamide (CAS 332101-53-8) is a chemical compound with molecular formula C26H23N3O2S and molecular weight 441.1511 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1-benzoyl-5-phenylimidazol-2-yl)sulfanyl-N-(2,6-dimethylphenyl)acetamide
Also Known As: BAS 01118093, 2-((1-Benzoyl-5-phenyl-1H-imidazol-2-yl)thio)-N-(2,6-dimethylphenyl)acetamide, 2-(1-Benzoyl-5-phenyl-1H-imidazol-2-ylsulfanyl)-N-(2,6-dimethyl-phenyl)-acetamide, 2-(1-benzoyl-5-phenylimidazol-2-yl)sulfanyl-N-(2,6-dimethylphenyl)acetamide, 2-[(1-benzoyl-5-phenyl-1H-imidazol-2-yl)sulfanyl]-N-(2,6-dimethylphenyl)acetamide
| Molecular Formula | C26H23N3O2S |
| Molecular Weight | 441.1511 g/mol |
| XLogP | 5.7 |
| Topological Polar Surface Area (TPSA) | 89.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 441.1511 Da |
| Heavy Atoms | 32 |
| Complexity | 623.0 |
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)CSC2=NC=C(N2C(=O)C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | QGKRFQLYUVFCKG-UHFFFAOYSA-N |
The XLogP value of 5.7 indicates that 2-((1-Benzoyl-5-phenyl-1H-imidazol-2-yl)thio)-N-(2,6-dimethylphenyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((1-Benzoyl-5-phenyl-1H-imidazol-2-yl)thio)-N-(2,6-dimethylphenyl)acetamide. Following Lipinski's Rule of Five, 2-((1-Benzoyl-5-phenyl-1H-imidazol-2-yl)thio)-N-(2,6-dimethylphenyl)acetamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-((1-Benzoyl-5-phenyl-1H-imidazol-2-yl)thio)-N-(2,6-dimethylphenyl)acetamide is 332101-53-8.
The molecular formula of 2-((1-Benzoyl-5-phenyl-1H-imidazol-2-yl)thio)-N-(2,6-dimethylphenyl)acetamide is C26H23N3O2S.
The molecular weight of 2-((1-Benzoyl-5-phenyl-1H-imidazol-2-yl)thio)-N-(2,6-dimethylphenyl)acetamide is 441.1511 g/mol.
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