L793-3585 Screening compound: N-(4-ethylphenyl)-2-{1-[(4-methylphenyl)methyl]-1H-pyrrol-2-yl}-2-oxoacetamide

L793-3585 Screening compound: N-(4-ethylphenyl)-2-{1-[(4-methylphenyl)methyl]-1H-pyrrol-2-yl}-2-oxoacetamide
L793-3585 Screening compound: N-(4-ethylphenyl)-2-{1-[(4-methylphenyl)methyl]-1H-pyrrol-2-yl}-2-oxoacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L793-3585
N-(4-ethylphenyl)-2-{1-[(4-methylphenyl)methyl]-1H-pyrrol-2-yl}-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

L793-3585

Molecular Formula

C22H22N2O2 (C22 H22 N2 O2)

Compound Name

N-(4-ethylphenyl)-2-{1-[(4-methylphenyl)methyl]-1H-pyrrol-2-yl}-2-oxoacetamide

IUPAC name

N-(4-ethylphenyl)-2-{1-[(4-methylphenyl)methyl]-1H-pyrrol-2-yl}-2-oxoacetamide

SMILES

CCc(cc1)ccc1NC(C(c1cccn1Cc1ccc(C)cc1)=O)=O

InChI

InChI=1S/C22H22N2O2/c1-3-17-10-12-19(13-11-17)23-22(26)21(25)20-5-4-14-24(20)15-18-8-6-16(2)7-9-18/h4-14H,3,15H2,1-2H3,(H,23,26)

InChI Key

CZMTYKHANHNZPS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27474928

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.280

Distribution Coefficient, logD

5.279

Water Solubility, LogSw

-5.11

Polar Surface Area

38.658

Acid Dissociation Constant (pKa)

10.74

Base Dissociation Constant (pKb)

-0.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

L793-3585 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 L793-3585 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L793-3585?
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What is the minimum amount of L793-3585 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L793-3585
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L793-3585
  • 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 L793-3585 available by request