1683-5526 Screening compound: N-(2-benzoyl-4-chlorophenyl)-2-bromobenzamide

1683-5526 Screening compound: N-(2-benzoyl-4-chlorophenyl)-2-bromobenzamide
1683-5526 Screening compound: N-(2-benzoyl-4-chlorophenyl)-2-bromobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1683-5526
N-(2-benzoyl-4-chlorophenyl)-2-bromobenzamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

1683-5526

Molecular Formula

C20H13BrClNO2 (C20 H13 BrClNO2)

Compound Name

N-(2-benzoyl-4-chlorophenyl)-2-bromobenzamide

IUPAC name

N-(2-benzoyl-4-chlorophenyl)-2-bromobenzamide

SMILES

O=C(c1ccccc1)c(cc(cc1)Cl)c1NC(c(cccc1)c1Br)=O

InChI

InChI=1S/C20H13BrClNO2/c21-17-9-5-4-8-15(17)20(25)23-18-11-10-14(22)12-16(18)19(24)13-6-2-1-3-7-13/h1-12H,(H,23,25)

InChI Key

JNYVQLUPPGTDFP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01034298

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.69

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.133

Distribution Coefficient, logD

4.486

Water Solubility, LogSw

-5.55

Polar Surface Area

36.099

Acid Dissociation Constant (pKa)

6.86

Base Dissociation Constant (pKb)

-5.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1683-5526 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Frequent Hitters Library (7624 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with 1683-5526 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1683-5526?
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What is the minimum amount of 1683-5526 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1683-5526
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1683-5526
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 1683-5526 available by request