TL;DR: 3-bromo-4-tert-butyl-N-(3,5-dichlorophenyl)benzamide (CAS 501107-38-6) is a chemical compound with molecular formula C17H16BrCl2NO and molecular weight 398.97922 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-bromo-4-tert-butyl-N-(3,5-dichlorophenyl)benzamide
Also Known As: 3-bromo-4-tert-butyl-N-(3,5-dichlorophenyl)benzamide, AN-329/41435156
| Molecular Formula | C17H16BrCl2NO |
| Molecular Weight | 398.97922 g/mol |
| XLogP | 6.4 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 398.97922 Da |
| Heavy Atoms | 22 |
| Complexity | 389.0 |
| SMILES | CC(C)(C)C1=C(C=C(C=C1)C(=O)NC2=CC(=CC(=C2)Cl)Cl)Br |
| InChIKey | BPDJPIXYBKAYEE-UHFFFAOYSA-N |
The XLogP value of 6.4 indicates that 3-bromo-4-tert-butyl-N-(3,5-dichlorophenyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 3-bromo-4-tert-butyl-N-(3,5-dichlorophenyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-bromo-4-tert-butyl-N-(3,5-dichlorophenyl)benzamide has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 3-bromo-4-tert-butyl-N-(3,5-dichlorophenyl)benzamide is 501107-38-6.
The molecular formula of 3-bromo-4-tert-butyl-N-(3,5-dichlorophenyl)benzamide is C17H16BrCl2NO.
The molecular weight of 3-bromo-4-tert-butyl-N-(3,5-dichlorophenyl)benzamide is 398.97922 g/mol.
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