4182-0657 Screening compound: 7-[(2-chloro-4-fluorophenyl)methoxy]-4-phenyl-2H-chromen-2-one

4182-0657 Screening compound: 7-[(2-chloro-4-fluorophenyl)methoxy]-4-phenyl-2H-chromen-2-one
4182-0657 Screening compound: 7-[(2-chloro-4-fluorophenyl)methoxy]-4-phenyl-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4182-0657
7-[(2-chloro-4-fluorophenyl)methoxy]-4-phenyl-2H-chromen-2-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

4182-0657

Molecular Formula

C22H14ClFO3 (C22 H14 ClFO3)

Compound Name

7-[(2-chloro-4-fluorophenyl)methoxy]-4-phenyl-2H-chromen-2-one

IUPAC name

7-[(2-chloro-4-fluorophenyl)methoxy]-4-phenyl-2H-chromen-2-one

SMILES

O=C1Oc(cc(cc2)OCc(ccc(F)c3)c3Cl)c2C(c2ccccc2)=C1

InChI

InChI=1S/C22H14ClFO3/c23-20-10-16(24)7-6-15(20)13-26-17-8-9-18-19(14-4-2-1-3-5-14)12-22(25)27-21(18)11-17/h1-12H,13H2

InChI Key

GNSDVQDXDOERIR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02932406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.8

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.160

Distribution Coefficient, logD

5.160

Water Solubility, LogSw

-5.51

Polar Surface Area

27.602

Acid Dissociation Constant (pKa)

28.94

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

4182-0657 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Targets:
  • Others

References: we are preparing a list of scientific research reports with 4182-0657 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4182-0657?
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What is the minimum amount of 4182-0657 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4182-0657
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4182-0657
  • 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 4182-0657 available by request