3931-2242 Screening compound: 3-(4-chlorophenyl)-7-methoxy-2-(trifluoromethyl)-4H-chromen-4-one

3931-2242 Screening compound: 3-(4-chlorophenyl)-7-methoxy-2-(trifluoromethyl)-4H-chromen-4-one
3931-2242 Screening compound: 3-(4-chlorophenyl)-7-methoxy-2-(trifluoromethyl)-4H-chromen-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3931-2242
3-(4-chlorophenyl)-7-methoxy-2-(trifluoromethyl)-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

3931-2242

Molecular Formula

C17H10ClF3O3 (C17 H10 ClF3 O3)

Compound Name

3-(4-chlorophenyl)-7-methoxy-2-(trifluoromethyl)-4H-chromen-4-one

IUPAC name

3-(4-chlorophenyl)-7-methoxy-2-(trifluoromethyl)-4H-chromen-4-one

SMILES

COc(cc1)cc(OC(C(F)(F)F)=C2c(cc3)ccc3Cl)c1C2=O

InChI

InChI=1S/C17H10ClF3O3/c1-23-11-6-7-12-13(8-11)24-16(17(19,20)21)14(15(12)22)9-2-4-10(18)5-3-9/h2-8H,1H3

InChI Key

AMRHWDRFUWJXKY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02358746

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.71

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

4.803

Distribution Coefficient, logD

4.803

Water Solubility, LogSw

-4.97

Polar Surface Area

27.821

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

3931-2242 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3931-2242 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3931-2242?
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What is the minimum amount of 3931-2242 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3931-2242
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3931-2242
  • 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 3931-2242 available by request