L793-3242 Screening compound: 2-(1-benzyl-1H-pyrrol-2-yl)-N-(2-bromo-4-methylphenyl)-2-oxoacetamide

L793-3242 Screening compound: 2-(1-benzyl-1H-pyrrol-2-yl)-N-(2-bromo-4-methylphenyl)-2-oxoacetamide
L793-3242 Screening compound: 2-(1-benzyl-1H-pyrrol-2-yl)-N-(2-bromo-4-methylphenyl)-2-oxoacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L793-3242
2-(1-benzyl-1H-pyrrol-2-yl)-N-(2-bromo-4-methylphenyl)-2-oxoacetamide

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

L793-3242

Molecular Formula

C20H17BrN2O2 (C20 H17 BrN2 O2)

Compound Name

2-(1-benzyl-1H-pyrrol-2-yl)-N-(2-bromo-4-methylphenyl)-2-oxoacetamide

IUPAC name

2-(1-benzyl-1H-pyrrol-2-yl)-N-(2-bromo-4-methylphenyl)-2-oxoacetamide

SMILES

Cc(cc1)cc(Br)c1NC(C(c1cccn1Cc1ccccc1)=O)=O

InChI

InChI=1S/C20H17BrN2O2/c1-14-9-10-17(16(21)12-14)22-20(25)19(24)18-8-5-11-23(18)13-15-6-3-2-4-7-15/h2-12H,13H2,1H3,(H,22,25)

InChI Key

BJQAPZFPAXEALX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27474862

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.27

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.905

Distribution Coefficient, logD

4.903

Water Solubility, LogSw

-4.56

Polar Surface Area

37.960

Acid Dissociation Constant (pKa)

9.76

Base Dissociation Constant (pKb)

-2.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

L793-3242 in Drug Discovery

Included in Screening Libraries

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

Covalent Inhibitors Library (7986 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with L793-3242 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L793-3242?
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What is the minimum amount of L793-3242 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L793-3242
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L793-3242
  • 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 L793-3242 available by request