5174-0889 Screening compound: 3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl 3,5-dimethoxybenzoate

5174-0889 Screening compound: 3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl 3,5-dimethoxybenzoate
5174-0889 Screening compound: 3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl 3,5-dimethoxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 5174-0889
3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl 3,5-dimethoxybenzoate

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

5174-0889

Molecular Formula

C24H17ClO7 (C24 H17 ClO7)

Compound Name

3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl 3,5-dimethoxybenzoate

IUPAC name

3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl 35-dimethoxybenzoate

SMILES

COc1cc(C(Oc(cc2)cc(OC=C3Oc(cccc4)c4Cl)c2C3=O)=O)cc(OC)c1

InChI

InChI=1S/C24H17ClO7/c1-28-16-9-14(10-17(11-16)29-2)24(27)31-15-7-8-18-21(12-15)30-13-22(23(18)26)32-20-6-4-3-5-19(20)25/h3-13H,1-2H3

InChI Key

GMJXKJQSOKJYRC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02963796

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.85

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.650

Distribution Coefficient, logD

4.650

Water Solubility, LogSw

-5.01

Polar Surface Area

63.122

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

5174-0889 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system

References: we are preparing a list of scientific research reports with 5174-0889 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5174-0889?
Check Price and Availability of 5174-0889, 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 5174-0889 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5174-0889
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5174-0889
  • 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 5174-0889 available by request