L793-4342 Screening compound: 2-{1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-N-(3-methoxyphenyl)-2-oxoacetamide

L793-4342 Screening compound: 2-{1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-N-(3-methoxyphenyl)-2-oxoacetamide
L793-4342 Screening compound: 2-{1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-N-(3-methoxyphenyl)-2-oxoacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L793-4342
2-{1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-N-(3-methoxyphenyl)-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

L793-4342

Molecular Formula

C20H17FN2O3 (C20 H17 FN2 O3)

Compound Name

2-{1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-N-(3-methoxyphenyl)-2-oxoacetamide

IUPAC name

2-{1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-N-(3-methoxyphenyl)-2-oxoacetamide

SMILES

COc1cccc(NC(C(c2cccn2Cc(cc2)ccc2F)=O)=O)c1

InChI

InChI=1S/C20H17FN2O3/c1-26-17-5-2-4-16(12-17)22-20(25)19(24)18-6-3-11-23(18)13-14-7-9-15(21)10-8-14/h2-12H,13H2,1H3,(H,22,25)

InChI Key

QHNMHWAEKGSXEG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27475010

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.021

Distribution Coefficient, logD

4.020

Water Solubility, LogSw

-4.20

Polar Surface Area

46.201

Acid Dissociation Constant (pKa)

9.88

Base Dissociation Constant (pKb)

1.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

L793-4342 in Drug Discovery

Included in Screening Libraries

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 L793-4342 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L793-4342?
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What is the minimum amount of L793-4342 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L793-4342
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L793-4342
  • 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 L793-4342 available by request