3174-0828 Screening compound: ethyl 4-[(3-{[4-(ethoxycarbonyl)phenyl]amino}quinoxalin-2-yl)amino]benzoate

3174-0828 Screening compound: ethyl 4-[(3-{[4-(ethoxycarbonyl)phenyl]amino}quinoxalin-2-yl)amino]benzoate
3174-0828 Screening compound: ethyl 4-[(3-{[4-(ethoxycarbonyl)phenyl]amino}quinoxalin-2-yl)amino]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3174-0828
ethyl 4-[(3-{[4-(ethoxycarbonyl)phenyl]amino}quinoxalin-2-yl)amino]benzoate

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

3174-0828

Molecular Formula

C26H24N4O4 (C26 H24 N4 O4)

Compound Name

ethyl 4-[(3-{[4-(ethoxycarbonyl)phenyl]amino}quinoxalin-2-yl)amino]benzoate

IUPAC name

ethyl 4-[(3-{[4-(ethoxycarbonyl)phenyl]amino}quinoxalin-2-yl)amino]benzoate

SMILES

CCOC(c(cc1)ccc1Nc1nc2ccccc2nc1Nc(cc1)ccc1C(OCC)=O)=O

InChI

InChI=1S/C26H24N4O4/c1-3-33-25(31)17-9-13-19(14-10-17)27-23-24(30-22-8-6-5-7-21(22)29-23)28-20-15-11-18(12-16-20)26(32)34-4-2/h5-16H,3-4H2,1-2H3,(H,27,29)(H,28,30)

InChI Key

MBDSTLLOIMFSLL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01446264

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.615

Distribution Coefficient, logD

6.615

Water Solubility, LogSw

-5.86

Polar Surface Area

77.783

Acid Dissociation Constant (pKa)

17.42

Base Dissociation Constant (pKb)

2.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

3174-0828 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 3174-0828 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3174-0828?
Check Price and Availability of 3174-0828, 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 3174-0828 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3174-0828
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3174-0828
  • 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 3174-0828 available by request