J025-0117 Screening compound: 7-(2-bromophenyl)-3-phenyl-4H,5H,6H,7H-thieno[3,2-b]pyridin-5-one

J025-0117 Screening compound: 7-(2-bromophenyl)-3-phenyl-4H,5H,6H,7H-thieno[3,2-b]pyridin-5-one
J025-0117 Screening compound: 7-(2-bromophenyl)-3-phenyl-4H,5H,6H,7H-thieno[3,2-b]pyridin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound J025-0117
7-(2-bromophenyl)-3-phenyl-4H,5H,6H,7H-thieno[3,2-b]pyridin-5-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

J025-0117

Molecular Formula

C19H14BrNOS (C19 H14 BrNOS)

Compound Name

7-(2-bromophenyl)-3-phenyl-4H,5H,6H,7H-thieno[3,2-b]pyridin-5-one

IUPAC name

7-(2-bromophenyl)-3-phenyl-4H5H6H7H-thieno[32-b]pyridin-5-one

SMILES

O=C(CC1c(cccc2)c2Br)Nc2c1scc2-c1ccccc1

InChI

InChI=1S/C19H14BrNOS/c20-16-9-5-4-8-13(16)14-10-17(22)21-18-15(11-23-19(14)18)12-6-2-1-3-7-12/h1-9,11,14H,10H2,(H,21,22)/t14-/m1/s1

InChI Key

LFWSCGZUGGOYNS-CQSZACIVSA-N

MDL Number (MFCD)

MFCD27219339

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.3

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.734

Distribution Coefficient, logD

4.734

Water Solubility, LogSw

-4.81

Polar Surface Area

23.282

Acid Dissociation Constant (pKa)

13.39

Base Dissociation Constant (pKb)

-5.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

10.50

J025-0117 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with J025-0117 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J025-0117?
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What is the minimum amount of J025-0117 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J025-0117
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J025-0117
  • 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 J025-0117 available by request