D562-0148 Screening compound: 3-(4-chlorophenyl)-7-(4-ethoxy-3-methoxyphenyl)-5-oxo-4H,5H,6H,7H-thieno[3,2-b]pyridine-2-carboxylic acid

D562-0148 Screening compound: 3-(4-chlorophenyl)-7-(4-ethoxy-3-methoxyphenyl)-5-oxo-4H,5H,6H,7H-thieno[3,2-b]pyridine-2-carboxylic acid
D562-0148 Screening compound: 3-(4-chlorophenyl)-7-(4-ethoxy-3-methoxyphenyl)-5-oxo-4H,5H,6H,7H-thieno[3,2-b]pyridine-2-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound D562-0148
3-(4-chlorophenyl)-7-(4-ethoxy-3-methoxyphenyl)-5-oxo-4H,5H,6H,7H-thieno[3,2-b]pyridine-2-carboxylic acid

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

D562-0148

Molecular Formula

C23H20ClNO5S (C23 H20 ClNO5 S)

Compound Name

3-(4-chlorophenyl)-7-(4-ethoxy-3-methoxyphenyl)-5-oxo-4H,5H,6H,7H-thieno[3,2-b]pyridine-2-carboxylic acid

IUPAC name

3-(4-chlorophenyl)-7-(4-ethoxy-3-methoxyphenyl)-5-oxo-4H5H6H7H-thieno[32-b]pyridine-2-carboxylic acid

SMILES

CCOc(ccc(C(C1)c(sc(C(O)=O)c2-c(cc3)ccc3Cl)c2NC1=O)c1)c1OC

InChI

InChI=1S/C23H20ClNO5S/c1-3-30-16-9-6-13(10-17(16)29-2)15-11-18(26)25-20-19(12-4-7-14(24)8-5-12)22(23(27)28)31-21(15)20/h4-10,15H,3,11H2,1-2H3,(H,25,26)(H,27,28)/t15-/m0/s1

InChI Key

FAKYSODSVDWISF-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD27592350

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.93

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.187

Distribution Coefficient, logD

2.387

Water Solubility, LogSw

-4.76

Polar Surface Area

66.531

Acid Dissociation Constant (pKa)

5.61

Base Dissociation Constant (pKb)

-6.44

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.70

References: we are preparing a list of scientific research reports with D562-0148 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D562-0148?
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What is the minimum amount of D562-0148 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D562-0148
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D562-0148
  • 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 D562-0148 available by request