structure of tert-butyl 4-benzoylphenylcarbamate

tert-butyl 4-benzoylphenylcarbamate

CAS No.: 232597-43-2
M. Wt: 297.34800
M. Fa: C18H19NO3
InChI Key: -

Names and Identifiers of tert-butyl 4-benzoylphenylcarbamate

CAS Number

232597-43-2

IUPAC Name

tert-butyl N-[4-(phenylcarbonyl)phenyl]carbamate

Canonical SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)C2=CC=CC=C2

Physical and chemical properties of tert-butyl 4-benzoylphenylcarbamate

Exact Mass

297.13600

LogP

4.33760

Molecular Formula

C18H19NO3

Molecular Weight

297.34800

PSA

55.40000

Applications of tert-butyl 4-benzoylphenylcarbamate

tert-Butyl (4-benzoylphenyl)carbamate has several applications in:

  • Medicinal Chemistry: As a building block for synthesizing biologically active compounds.
  • Organic Synthesis: Utilized in the preparation of more complex structures through various chemical transformations.
  • Research: Employed in studies investigating enzyme inhibition and drug design due to its structural characteristics that may interact with biological targets.

Interaction Studies of tert-butyl 4-benzoylphenylcarbamate

Studies on the interactions of tert-butyl (4-benzoylphenyl)carbamate with biological systems have shown promise in understanding its mechanism of action. For example, molecular docking studies suggest that this compound may effectively bind to specific enzyme active sites, potentially leading to inhibition or modulation of enzymatic activity. Such interactions are critical for evaluating its therapeutic potential.

Biological Activity of tert-butyl 4-benzoylphenylcarbamate

Research indicates that compounds similar to tert-butyl (4-benzoylphenyl)carbamate exhibit various biological activities. For instance, derivatives of carbamates have been studied for their anti-inflammatory properties and as potential inhibitors in enzymatic pathways. The presence of the benzoyl moiety may enhance interactions with biological targets due to its aromatic nature, which could lead to increased efficacy in therapeutic applications.

Retrosynthesis analysis of tert-butyl 4-benzoylphenylcarbamate

  • Route#1

    Cas:4248-19-5
    Cas:90-90-4
    Cas:232597-43-2
  • Route#2

    Cas:1137-41-3
    Cas:24424-99-5
    Cas:232597-43-2