J025-0883 Screening compound: 3-(4-chlorophenyl)-7-(2,4-dimethoxyphenyl)-4H,5H,6H,7H-thieno[3,2-b]pyridin-5-one

J025-0883 Screening compound: 3-(4-chlorophenyl)-7-(2,4-dimethoxyphenyl)-4H,5H,6H,7H-thieno[3,2-b]pyridin-5-one
J025-0883 Screening compound: 3-(4-chlorophenyl)-7-(2,4-dimethoxyphenyl)-4H,5H,6H,7H-thieno[3,2-b]pyridin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound J025-0883
3-(4-chlorophenyl)-7-(2,4-dimethoxyphenyl)-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

J025-0883

Molecular Formula

C21H18ClNO3S (C21 H18 ClNO3 S)

Compound Name

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

IUPAC name

3-(4-chlorophenyl)-7-(24-dimethoxyphenyl)-4H5H6H7H-thieno[32-b]pyridin-5-one

SMILES

COc1cc(OC)c(C(C2)c(scc3-c(cc4)ccc4Cl)c3NC2=O)cc1

InChI

InChI=1S/C21H18ClNO3S/c1-25-14-7-8-15(18(9-14)26-2)16-10-19(24)23-20-17(11-27-21(16)20)12-3-5-13(22)6-4-12/h3-9,11,16H,10H2,1-2H3,(H,23,24)/t16-/m0/s1

InChI Key

SVGZEBLQUPGOQA-INIZCTEOSA-N

MDL Number (MFCD)

MFCD15078879

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.9

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.925

Distribution Coefficient, logD

4.925

Water Solubility, LogSw

-5.04

Polar Surface Area

38.457

Acid Dissociation Constant (pKa)

13.23

Base Dissociation Constant (pKb)

-5.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

J025-0883 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with J025-0883 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J025-0883?
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What is the minimum amount of J025-0883 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J025-0883
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J025-0883
  • 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 J025-0883 available by request