D563-0021 Screening compound: 3-(benzenesulfonyl)-7-(4-propoxyphenyl)-4H,5H,6H,7H-thieno[3,2-b]pyridin-5-one

D563-0021 Screening compound: 3-(benzenesulfonyl)-7-(4-propoxyphenyl)-4H,5H,6H,7H-thieno[3,2-b]pyridin-5-one
D563-0021 Screening compound: 3-(benzenesulfonyl)-7-(4-propoxyphenyl)-4H,5H,6H,7H-thieno[3,2-b]pyridin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D563-0021
3-(benzenesulfonyl)-7-(4-propoxyphenyl)-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

D563-0021

Molecular Formula

C22H21NO4S2 (C22 H21 NO4 S2)

Compound Name

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

IUPAC name

3-(benzenesulfonyl)-7-(4-propoxyphenyl)-4H5H6H7H-thieno[32-b]pyridin-5-one

SMILES

CCCOc1ccc(C(C2)c(scc3S(c4ccccc4)(=O)=O)c3NC2=O)cc1

InChI

InChI=1S/C22H21NO4S2/c1-2-12-27-16-10-8-15(9-11-16)18-13-20(24)23-21-19(14-28-22(18)21)29(25,26)17-6-4-3-5-7-17/h3-11,14,18H,2,12-13H2,1H3,(H,23,24)/t18-/m0/s1

InChI Key

ABTAANFUVXZIBP-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27592677

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.029

Distribution Coefficient, logD

4.029

Water Solubility, LogSw

-3.98

Polar Surface Area

60.473

Acid Dissociation Constant (pKa)

11.34

Base Dissociation Constant (pKb)

-8.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.70

References: we are preparing a list of scientific research reports with D563-0021 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D563-0021?
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What is the minimum amount of D563-0021 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D563-0021
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D563-0021
  • 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 D563-0021 available by request