E209-1116 Screening compound: N-(4-bromophenyl)-2-[4-(3,4-dimethoxyphenyl)-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl]acetamide

E209-1116 Screening compound: N-(4-bromophenyl)-2-[4-(3,4-dimethoxyphenyl)-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl]acetamide
E209-1116 Screening compound: N-(4-bromophenyl)-2-[4-(3,4-dimethoxyphenyl)-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E209-1116
N-(4-bromophenyl)-2-[4-(3,4-dimethoxyphenyl)-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl]acetamide

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

E209-1116

Molecular Formula

C20H18BrN3O5 (C20 H18 BrN3 O5)

Compound Name

N-(4-bromophenyl)-2-[4-(3,4-dimethoxyphenyl)-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl]acetamide

IUPAC name

N-(4-bromophenyl)-2-[4-(34-dimethoxyphenyl)-23-dioxo-1234-tetrahydropyrazin-1-yl]acetamide

SMILES

COc(ccc(N(C=CN(CC(Nc(cc1)ccc1Br)=O)C1=O)C1=O)c1)c1OC

InChI

InChI=1S/C20H18BrN3O5/c1-28-16-8-7-15(11-17(16)29-2)24-10-9-23(19(26)20(24)27)12-18(25)22-14-5-3-13(21)4-6-14/h3-11H,12H2,1-2H3,(H,22,25)

InChI Key

QZEKFZVTSDECFW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08140988

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.28

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.758

Distribution Coefficient, logD

1.758

Water Solubility, LogSw

-2.50

Polar Surface Area

69.439

Acid Dissociation Constant (pKa)

11.09

Base Dissociation Constant (pKb)

-6.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with E209-1116 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E209-1116?
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What is the minimum amount of E209-1116 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E209-1116
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E209-1116
  • 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 E209-1116 available by request