7029-3670 Screening compound: 4-bromobenzyl 3-(3-hydroxy-2-quinoxalinyl)propanoate

7029-3670 Screening compound: 4-bromobenzyl 3-(3-hydroxy-2-quinoxalinyl)propanoate
7029-3670 Screening compound: 4-bromobenzyl 3-(3-hydroxy-2-quinoxalinyl)propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 7029-3670
4-bromobenzyl 3-(3-hydroxy-2-quinoxalinyl)propanoate

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

7029-3670

Molecular Formula

C18H15BrN2O3 (C18 H15 BrN2 O3)

Compound Name

4-bromobenzyl 3-(3-hydroxy-2-quinoxalinyl)propanoate

IUPAC name

(4-bromophenyl)methyl 3-(3-hydroxyquinoxalin-2-yl)propanoate

SMILES

Oc1nc2ccccc2nc1CCC(OCc(cc1)ccc1Br)=O

InChI

InChI=1S/C18H15BrN2O3/c19-13-7-5-12(6-8-13)11-24-17(22)10-9-16-18(23)21-15-4-2-1-3-14(15)20-16/h1-8H,9-11H2,(H,21,23)

InChI Key

WCCMITQACLYYGT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05106032

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.23

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.073

Distribution Coefficient, logD

3.840

Water Solubility, LogSw

-4.28

Polar Surface Area

55.660

Acid Dissociation Constant (pKa)

7.55

Base Dissociation Constant (pKb)

3.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

7029-3670 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 7029-3670 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7029-3670?
Check Price and Availability of 7029-3670, 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 7029-3670 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7029-3670
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7029-3670
  • 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 7029-3670 available by request