3931-2056 Screening compound: 3-(2-chlorophenyl)-7-ethoxy-4H-chromen-4-one

3931-2056 Screening compound: 3-(2-chlorophenyl)-7-ethoxy-4H-chromen-4-one
3931-2056 Screening compound: 3-(2-chlorophenyl)-7-ethoxy-4H-chromen-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3931-2056
3-(2-chlorophenyl)-7-ethoxy-4H-chromen-4-one

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

3931-2056

Molecular Formula

C17H13ClO3 (C17 H13 ClO3)

Compound Name

3-(2-chlorophenyl)-7-ethoxy-4H-chromen-4-one

IUPAC name

3-(2-chlorophenyl)-7-ethoxy-4H-chromen-4-one

SMILES

CCOc(cc1)cc(OC=C2c(cccc3)c3Cl)c1C2=O

InChI

InChI=1S/C17H13ClO3/c1-2-20-11-7-8-13-16(9-11)21-10-14(17(13)19)12-5-3-4-6-15(12)18/h3-10H,2H2,1H3

InChI Key

PCQAZCQSJUPOBG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02358571

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

300.74

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.977

Distribution Coefficient, logD

3.977

Water Solubility, LogSw

-4.37

Polar Surface Area

27.984

Acid Dissociation Constant (pKa)

29.85

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

3931-2056 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 3931-2056 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3931-2056?
Check Price and Availability of 3931-2056, 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 3931-2056 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3931-2056
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3931-2056
  • 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 3931-2056 available by request