D401-0272 Screening compound: 3-{[2-(4-chlorophenyl)imidazo[1,2-a]pyrazin-3-yl]amino}-N-ethylbenzamide

D401-0272 Screening compound: 3-{[2-(4-chlorophenyl)imidazo[1,2-a]pyrazin-3-yl]amino}-N-ethylbenzamide
D401-0272 Screening compound: 3-{[2-(4-chlorophenyl)imidazo[1,2-a]pyrazin-3-yl]amino}-N-ethylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D401-0272
3-{[2-(4-chlorophenyl)imidazo[1,2-a]pyrazin-3-yl]amino}-N-ethylbenzamide

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

D401-0272

Molecular Formula

C21H18ClN5O (C21 H18 ClN5 O)

Compound Name

3-{[2-(4-chlorophenyl)imidazo[1,2-a]pyrazin-3-yl]amino}-N-ethylbenzamide

IUPAC name

3-{[2-(4-chlorophenyl)imidazo[12-a]pyrazin-3-yl]amino}-N-ethylbenzamide

SMILES

CCNC(c1cccc(Nc2c(-c(cc3)ccc3Cl)nc3n2ccnc3)c1)=O

InChI

InChI=1S/C21H18ClN5O/c1-2-24-21(28)15-4-3-5-17(12-15)25-20-19(14-6-8-16(22)9-7-14)26-18-13-23-10-11-27(18)20/h3-13,25H,2H2,1H3,(H,24,28)

InChI Key

UPXJPLYQGZERGJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27584232

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.86

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.656

Distribution Coefficient, logD

3.656

Water Solubility, LogSw

-4.12

Polar Surface Area

51.507

Acid Dissociation Constant (pKa)

13.97

Base Dissociation Constant (pKb)

4.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

D401-0272 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Protein-Protein Interaction Library (218420 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • PPI modulators
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D401-0272 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D401-0272?
Check Price and Availability of D401-0272, 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 D401-0272 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D401-0272
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D401-0272
  • 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 D401-0272 available by request