E209-1205 Screening compound: 2-[4-(3,4-difluorophenyl)-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl]-N-(3,5-dimethoxyphenyl)acetamide

E209-1205 Screening compound: 2-[4-(3,4-difluorophenyl)-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl]-N-(3,5-dimethoxyphenyl)acetamide
E209-1205 Screening compound: 2-[4-(3,4-difluorophenyl)-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl]-N-(3,5-dimethoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E209-1205
2-[4-(3,4-difluorophenyl)-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl]-N-(3,5-dimethoxyphenyl)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

E209-1205

Molecular Formula

C20H17F2N3O5 (C20 H17 F2 N3 O5)

Compound Name

2-[4-(3,4-difluorophenyl)-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl]-N-(3,5-dimethoxyphenyl)acetamide

IUPAC name

2-[4-(34-difluorophenyl)-23-dioxo-1234-tetrahydropyrazin-1-yl]-N-(35-dimethoxyphenyl)acetamide

SMILES

COc1cc(NC(CN(C=CN(c(cc2)cc(F)c2F)C2=O)C2=O)=O)cc(OC)c1

InChI

InChI=1S/C20H17F2N3O5/c1-29-14-7-12(8-15(10-14)30-2)23-18(26)11-24-5-6-25(20(28)19(24)27)13-3-4-16(21)17(22)9-13/h3-10H,11H2,1-2H3,(H,23,26)

InChI Key

QCOCNBQMAXZZTA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14847026

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.37

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

1.774

Distribution Coefficient, logD

1.774

Water Solubility, LogSw

-2.45

Polar Surface Area

69.266

Acid Dissociation Constant (pKa)

10.93

Base Dissociation Constant (pKb)

0.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

E209-1205 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with E209-1205 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E209-1205?
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What is the minimum amount of E209-1205 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E209-1205
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E209-1205
  • 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 E209-1205 available by request