structure of N-(2-benzamidophenyl)benzamide

N-(2-benzamidophenyl)benzamide

CAS No.: 744-38-7
M. Wt: 316.35300
M. Fa: C20H16N2O2
InChI Key: PDRZOLRKTPJCNY-UHFFFAOYSA-N

Names and Identifiers of N-(2-benzamidophenyl)benzamide

CAS Number

744-38-7

EC Number

662-741-1

IUPAC Name

N-(2-benzamidophenyl)benzamide

InChI

InChI=1S/C20H16N2O2/c23-19(15-9-3-1-4-10-15)21-17-13-7-8-14-18(17)22-20(24)16-11-5-2-6-12-16/h1-14H,(H,21,23)(H,22,24)

InChIKey

PDRZOLRKTPJCNY-UHFFFAOYSA-N

Canonical SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2NC(=O)C3=CC=CC=C3

Physical and chemical properties of N-(2-benzamidophenyl)benzamide

Boiling Point

358.2ºC at 760 mmHg

Density

1.279g/cm3

Exact Mass

316.12100

Flash Point

103.8ºC

Index of Refraction

1.698

LogP

4.33720

Molecular Formula

C20H16N2O2

Molecular Weight

316.35300

PSA

58.20000

Safety Information of N-(2-benzamidophenyl)benzamide

Pictograms

Signal Word

Warning

Safety Data Sheet

Supports customized editing of SDS information and downloading in PDF documents.

Applications of N-(2-benzamidophenyl)benzamide

N-(2-benzamidophenyl)benzamide has potential applications in various fields:

  • Pharmaceuticals: As a lead compound in drug development, particularly for anticancer therapies targeting PARP enzymes.
  • Chemical Research: Used as a building block in organic synthesis to create more complex molecules.
  • Material Science: Potential applications in developing new materials due to its unique structural properties.

Interaction Studies of N-(2-benzamidophenyl)benzamide

Interaction studies involving N-(2-benzamidophenyl)benzamide have focused on its binding affinity to target proteins involved in cancer cell proliferation and survival. These studies utilize techniques such as molecular docking and surface plasmon resonance to elucidate binding mechanisms and affinities. Such interactions are critical for understanding the compound's efficacy as a therapeutic agent.

Biological Activity of N-(2-benzamidophenyl)benzamide

N-(2-benzamidophenyl)benzamide has been investigated for its potential biological activities, particularly in the context of cancer therapy. Studies suggest that derivatives of benzamide compounds can act as inhibitors for key enzymes involved in cancer progression, such as poly(ADP-ribose) polymerase-1 (PARP-1). This inhibition is crucial in cancer treatment strategies aimed at exploiting DNA repair mechanisms.

Moreover, research has indicated that similar compounds exhibit antitumor activity by targeting specific cellular pathways, making N-(2-benzamidophenyl)benzamide a candidate for further pharmacological studies.

Retrosynthesis analysis of N-(2-benzamidophenyl)benzamide

  • Route#1

    Cas:29670-64-2
    Cas:744-38-7
  • Route#2

    Cas:65-85-0
    Cas:95-54-5
    Cas:744-38-7
  • Route#3

    Cas:39145-59-0
    Cas:7732-18-5
    Cas:98-88-4
    Cas:744-38-7