L793-3245 Screening compound: 2-(1-benzyl-1H-pyrrol-2-yl)-N-(3,4-dimethylphenyl)-2-oxoacetamide

L793-3245 Screening compound: 2-(1-benzyl-1H-pyrrol-2-yl)-N-(3,4-dimethylphenyl)-2-oxoacetamide
L793-3245 Screening compound: 2-(1-benzyl-1H-pyrrol-2-yl)-N-(3,4-dimethylphenyl)-2-oxoacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L793-3245
2-(1-benzyl-1H-pyrrol-2-yl)-N-(3,4-dimethylphenyl)-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

L793-3245

Molecular Formula

C21H20N2O2 (C21 H20 N2 O2)

Compound Name

2-(1-benzyl-1H-pyrrol-2-yl)-N-(3,4-dimethylphenyl)-2-oxoacetamide

IUPAC name

2-(1-benzyl-1H-pyrrol-2-yl)-N-(34-dimethylphenyl)-2-oxoacetamide

SMILES

Cc(cc1)c(C)cc1NC(C(c1cccn1Cc1ccccc1)=O)=O

InChI

InChI=1S/C21H20N2O2/c1-15-10-11-18(13-16(15)2)22-21(25)20(24)19-9-6-12-23(19)14-17-7-4-3-5-8-17/h3-13H,14H2,1-2H3,(H,22,25)

InChI Key

CTFCJHVBRRLANS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27474864

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.4

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

4.913

Distribution Coefficient, logD

4.913

Water Solubility, LogSw

-4.57

Polar Surface Area

38.658

Acid Dissociation Constant (pKa)

10.92

Base Dissociation Constant (pKb)

2.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

L793-3245 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 L793-3245 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L793-3245?
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What is the minimum amount of L793-3245 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L793-3245
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L793-3245
  • 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 L793-3245 available by request