E209-0487 Screening compound: 2-{4-[(4-chlorophenyl)methyl]-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl}-N-(2-methoxyphenyl)acetamide

E209-0487 Screening compound: 2-{4-[(4-chlorophenyl)methyl]-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl}-N-(2-methoxyphenyl)acetamide
E209-0487 Screening compound: 2-{4-[(4-chlorophenyl)methyl]-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl}-N-(2-methoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E209-0487
2-{4-[(4-chlorophenyl)methyl]-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl}-N-(2-methoxyphenyl)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

E209-0487

Molecular Formula

C20H18ClN3O4 (C20 H18 ClN3 O4)

Compound Name

2-{4-[(4-chlorophenyl)methyl]-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl}-N-(2-methoxyphenyl)acetamide

IUPAC name

2-{4-[(4-chlorophenyl)methyl]-23-dioxo-1234-tetrahydropyrazin-1-yl}-N-(2-methoxyphenyl)acetamide

SMILES

COc(cccc1)c1NC(CN(C=CN(Cc(cc1)ccc1Cl)C1=O)C1=O)=O

InChI

InChI=1S/C20H18ClN3O4/c1-28-17-5-3-2-4-16(17)22-18(25)13-24-11-10-23(19(26)20(24)27)12-14-6-8-15(21)9-7-14/h2-11H,12-13H2,1H3,(H,22,25)

InChI Key

SDYAGKDTYNMHQT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14846700

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.83

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.525

Distribution Coefficient, logD

1.525

Water Solubility, LogSw

-2.46

Polar Surface Area

61.557

Acid Dissociation Constant (pKa)

11.44

Base Dissociation Constant (pKb)

-0.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with E209-0487 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E209-0487?
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What is the minimum amount of E209-0487 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E209-0487
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E209-0487
  • 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 E209-0487 available by request