P163-0069 Screening compound: ethyl 4-{7-hydroxy-5-oxo-4H,5H-thieno[3,2-b]pyridine-6-amido}benzoate

P163-0069 Screening compound: ethyl 4-{7-hydroxy-5-oxo-4H,5H-thieno[3,2-b]pyridine-6-amido}benzoate
P163-0069 Screening compound: ethyl 4-{7-hydroxy-5-oxo-4H,5H-thieno[3,2-b]pyridine-6-amido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound P163-0069
ethyl 4-{7-hydroxy-5-oxo-4H,5H-thieno[3,2-b]pyridine-6-amido}benzoate

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

P163-0069

Molecular Formula

C17H14N2O5S (C17 H14 N2 O5 S)

Compound Name

ethyl 4-{7-hydroxy-5-oxo-4H,5H-thieno[3,2-b]pyridine-6-amido}benzoate

IUPAC name

ethyl 4-{7-hydroxy-5-oxo-4H5H-thieno[32-b]pyridine-6-amido}benzoate

SMILES

CCOC(c(cc1)ccc1NC(C(C(Nc1c2scc1)=O)=C2O)=O)=O

InChI

InChI=1S/C17H14N2O5S/c1-2-24-17(23)9-3-5-10(6-4-9)18-15(21)12-13(20)14-11(7-8-25-14)19-16(12)22/h3-8H,2H2,1H3,(H,18,21)(H2,19,20,22)

InChI Key

YFRUZZWDZMXYRV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27567237

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.37

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.446

Distribution Coefficient, logD

-4.137

Water Solubility, LogSw

-2.87

Polar Surface Area

85.050

Acid Dissociation Constant (pKa)

0.82

Base Dissociation Constant (pKb)

-2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

P163-0069 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with P163-0069 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P163-0069?
Check Price and Availability of P163-0069, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of P163-0069 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P163-0069
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P163-0069
  • 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 P163-0069 available by request