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CAS 874290-98-9

:

1-benzyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea

Description:
1-Benzyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea is a chemical compound characterized by its unique structure, which includes a urea functional group and a boron-containing moiety. The presence of the tetramethyl-1,3,2-dioxaborolane ring contributes to its potential applications in organic synthesis and medicinal chemistry, particularly in the development of boron-based reagents. This compound typically exhibits moderate solubility in organic solvents and may have specific reactivity due to the boron atom, which can participate in various chemical transformations. The urea group can engage in hydrogen bonding, influencing its interactions with biological targets or other molecules. Additionally, the benzyl and phenyl substituents can enhance lipophilicity, potentially affecting its pharmacokinetic properties. Overall, this compound's structural features suggest it may be of interest in research areas such as drug development, catalysis, and materials science.
Formula:C20H25BN2O3
InChI:InChI=1/C20H25BN2O3/c1-19(2)20(3,4)26-21(25-19)16-10-12-17(13-11-16)23-18(24)22-14-15-8-6-5-7-9-15/h5-13H,14H2,1-4H3,(H2,22,23,24)
SMILES:CC1(C)C(C)(C)OB(c2ccc(cc2)NC(=NCc2ccccc2)O)O1
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