3643-2285 Screening compound: 7-(benzyloxy)-3-(3,4-dimethoxyphenyl)-2-(trifluoromethyl)-4H-chromen-4-one

3643-2285 Screening compound: 7-(benzyloxy)-3-(3,4-dimethoxyphenyl)-2-(trifluoromethyl)-4H-chromen-4-one
3643-2285 Screening compound: 7-(benzyloxy)-3-(3,4-dimethoxyphenyl)-2-(trifluoromethyl)-4H-chromen-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3643-2285
7-(benzyloxy)-3-(3,4-dimethoxyphenyl)-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

3643-2285

Molecular Formula

C25H19F3O5 (C25 H19 F3 O5)

Compound Name

7-(benzyloxy)-3-(3,4-dimethoxyphenyl)-2-(trifluoromethyl)-4H-chromen-4-one

IUPAC name

7-(benzyloxy)-3-(34-dimethoxyphenyl)-2-(trifluoromethyl)-4H-chromen-4-one

SMILES

COc(ccc(C1=C(C(F)(F)F)Oc(cc(cc2)OCc3ccccc3)c2C1=O)c1)c1OC

InChI

InChI=1S/C25H19F3O5/c1-30-19-11-8-16(12-21(19)31-2)22-23(29)18-10-9-17(32-14-15-6-4-3-5-7-15)13-20(18)33-24(22)25(26,27)28/h3-13H,14H2,1-2H3

InChI Key

BFNDIZPUHOMILN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02350564

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.244

Distribution Coefficient, logD

5.244

Water Solubility, LogSw

-5.23

Polar Surface Area

42.766

Acid Dissociation Constant (pKa)

29.40

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

3643-2285 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 3643-2285 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3643-2285?
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What is the minimum amount of 3643-2285 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3643-2285
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3643-2285
  • 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 3643-2285 available by request