L793-0439 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-methyl-1H-pyrrol-2-yl)-2-oxoacetamide

L793-0439 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-methyl-1H-pyrrol-2-yl)-2-oxoacetamide
L793-0439 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-methyl-1H-pyrrol-2-yl)-2-oxoacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L793-0439
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-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

L793-0439

Molecular Formula

C17H20N2O4 (C17 H20 N2 O4)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(1-methyl-1H-pyrrol-2-yl)-2-oxoacetamide

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-2-(1-methyl-1H-pyrrol-2-yl)-2-oxoacetamide

SMILES

Cn1c(C(C(NCCc(cc2)cc(OC)c2OC)=O)=O)ccc1

InChI

InChI=1S/C17H20N2O4/c1-19-10-4-5-13(19)16(20)17(21)18-9-8-12-6-7-14(22-2)15(11-12)23-3/h4-7,10-11H,8-9H2,1-3H3,(H,18,21)

InChI Key

HIMVKNQPDSURGA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27474738

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.787

Distribution Coefficient, logD

1.787

Water Solubility, LogSw

-2.28

Polar Surface Area

55.910

Acid Dissociation Constant (pKa)

12.46

Base Dissociation Constant (pKb)

0.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

L793-0439 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with L793-0439 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L793-0439?
Check Price and Availability of L793-0439, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of L793-0439 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L793-0439
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L793-0439
  • 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 L793-0439 available by request