4789-4357 Screening compound: ethyl 6-bromo-4-[(3,4-dimethoxyphenyl)amino]quinoline-3-carboxylate

4789-4357 Screening compound: ethyl 6-bromo-4-[(3,4-dimethoxyphenyl)amino]quinoline-3-carboxylate
4789-4357 Screening compound: ethyl 6-bromo-4-[(3,4-dimethoxyphenyl)amino]quinoline-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4789-4357
ethyl 6-bromo-4-[(3,4-dimethoxyphenyl)amino]quinoline-3-carboxylate

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

4789-4357

Molecular Formula

C20H19BrN2O4 (C20 H19 BrN2 O4)

Compound Name

ethyl 6-bromo-4-[(3,4-dimethoxyphenyl)amino]quinoline-3-carboxylate

IUPAC name

ethyl 6-bromo-4-[(34-dimethoxyphenyl)amino]quinoline-3-carboxylate

SMILES

CCOC(c1cnc(ccc(Br)c2)c2c1Nc(cc1)cc(OC)c1OC)=O

InChI

InChI=1S/C20H19BrN2O4/c1-4-27-20(24)15-11-22-16-7-5-12(21)9-14(16)19(15)23-13-6-8-17(25-2)18(10-13)26-3/h5-11H,4H2,1-3H3,(H,22,23)

InChI Key

QNUZDQZKKGQUSS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02968552

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.29

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.514

Distribution Coefficient, logD

4.514

Water Solubility, LogSw

-4.22

Polar Surface Area

52.622

Acid Dissociation Constant (pKa)

14.58

Base Dissociation Constant (pKb)

3.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

4789-4357 in Drug Discovery

Included in Screening Libraries

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 4789-4357 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4789-4357?
Check Price and Availability of 4789-4357, 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 4789-4357 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4789-4357
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4789-4357
  • 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 4789-4357 available by request