1798-0123 Screening compound: N-(4-bromophenyl)-2-(2-fluorobenzamido)benzamide

1798-0123 Screening compound: N-(4-bromophenyl)-2-(2-fluorobenzamido)benzamide
1798-0123 Screening compound: N-(4-bromophenyl)-2-(2-fluorobenzamido)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1798-0123
N-(4-bromophenyl)-2-(2-fluorobenzamido)benzamide

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

1798-0123

Molecular Formula

C20H14BrFN2O2 (C20 H14 BrFN2 O2)

Compound Name

N-(4-bromophenyl)-2-(2-fluorobenzamido)benzamide

IUPAC name

N-(4-bromophenyl)-2-(2-fluorobenzamido)benzamide

SMILES

O=C(c(cccc1)c1NC(c(cccc1)c1F)=O)Nc(cc1)ccc1Br

InChI

InChI=1S/C20H14BrFN2O2/c21-13-9-11-14(12-10-13)23-20(26)16-6-2-4-8-18(16)24-19(25)15-5-1-3-7-17(15)22/h1-12H,(H,23,26)(H,24,25)

InChI Key

VPYIGNOZTFYSLI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00852858

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.25

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.597

Distribution Coefficient, logD

4.584

Water Solubility, LogSw

-4.60

Polar Surface Area

45.723

Acid Dissociation Constant (pKa)

8.93

Base Dissociation Constant (pKb)

-2.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1798-0123 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system

References: we are preparing a list of scientific research reports with 1798-0123 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1798-0123?
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What is the minimum amount of 1798-0123 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1798-0123
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1798-0123
  • 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 1798-0123 available by request