8539-0590 Screening compound: 2-(4-chlorophenyl)-4-(4-fluorophenyl)-5H-chromeno[4,3-b]pyridine

8539-0590 Screening compound: 2-(4-chlorophenyl)-4-(4-fluorophenyl)-5H-chromeno[4,3-b]pyridine
8539-0590 Screening compound: 2-(4-chlorophenyl)-4-(4-fluorophenyl)-5H-chromeno[4,3-b]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8539-0590
2-(4-chlorophenyl)-4-(4-fluorophenyl)-5H-chromeno[4,3-b]pyridine

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

8539-0590

Molecular Formula

C24H15ClFNO (C24 H15 ClFNO)

Compound Name

2-(4-chlorophenyl)-4-(4-fluorophenyl)-5H-chromeno[4,3-b]pyridine

IUPAC name

2-(4-chlorophenyl)-4-(4-fluorophenyl)-5H-chromeno[43-b]pyridine

SMILES

Fc(cc1)ccc1-c1cc(-c(cc2)ccc2Cl)nc-2c1COc1c2cccc1

InChI

InChI=1S/C24H15ClFNO/c25-17-9-5-16(6-10-17)22-13-20(15-7-11-18(26)12-8-15)21-14-28-23-4-2-1-3-19(23)24(21)27-22/h1-13H,14H2

InChI Key

VLJAWRXIDIOZMY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08278886

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.84

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

7.269

Distribution Coefficient, logD

7.250

Water Solubility, LogSw

-6.73

Polar Surface Area

17.271

Acid Dissociation Constant (pKa)

19.94

Base Dissociation Constant (pKb)

6.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.20

8539-0590 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8539-0590 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8539-0590?
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What is the minimum amount of 8539-0590 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8539-0590
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8539-0590
  • 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 8539-0590 available by request