D563-0109 Screening compound: 3-(benzenesulfonyl)-7-[2-(2-methylpropoxy)phenyl]-4H,5H,6H,7H-thieno[3,2-b]pyridin-5-one

D563-0109 Screening compound: 3-(benzenesulfonyl)-7-[2-(2-methylpropoxy)phenyl]-4H,5H,6H,7H-thieno[3,2-b]pyridin-5-one
D563-0109 Screening compound: 3-(benzenesulfonyl)-7-[2-(2-methylpropoxy)phenyl]-4H,5H,6H,7H-thieno[3,2-b]pyridin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D563-0109
3-(benzenesulfonyl)-7-[2-(2-methylpropoxy)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

D563-0109

Molecular Formula

C23H23NO4S2 (C23 H23 NO4 S2)

Compound Name

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

IUPAC name

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

SMILES

CC(C)COc1c(C(C2)c(scc3S(c4ccccc4)(=O)=O)c3NC2=O)cccc1

InChI

InChI=1S/C23H23NO4S2/c1-15(2)13-28-19-11-7-6-10-17(19)18-12-21(25)24-22-20(14-29-23(18)22)30(26,27)16-8-4-3-5-9-16/h3-11,14-15,18H,12-13H2,1-2H3,(H,24,25)/t18-/m0/s1

InChI Key

TYOKTUGBSDGEGV-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27592757

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.57

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

4.837

Distribution Coefficient, logD

4.837

Water Solubility, LogSw

-4.52

Polar Surface Area

60.641

Acid Dissociation Constant (pKa)

11.34

Base Dissociation Constant (pKb)

-8.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.10

References: we are preparing a list of scientific research reports with D563-0109 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D563-0109?
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What is the minimum amount of D563-0109 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D563-0109
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D563-0109
  • 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 D563-0109 available by request