P328-1685 Screening compound: ethyl 3-{5-[(4-fluorophenyl)methyl]-2-methyl-4-oxo-4H,5H-furo[3,2-c]pyridine-3-amido}benzoate

P328-1685 Screening compound: ethyl 3-{5-[(4-fluorophenyl)methyl]-2-methyl-4-oxo-4H,5H-furo[3,2-c]pyridine-3-amido}benzoate
P328-1685 Screening compound: ethyl 3-{5-[(4-fluorophenyl)methyl]-2-methyl-4-oxo-4H,5H-furo[3,2-c]pyridine-3-amido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound P328-1685
ethyl 3-{5-[(4-fluorophenyl)methyl]-2-methyl-4-oxo-4H,5H-furo[3,2-c]pyridine-3-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

P328-1685

Molecular Formula

C25H21FN2O5 (C25 H21 FN2 O5)

Compound Name

ethyl 3-{5-[(4-fluorophenyl)methyl]-2-methyl-4-oxo-4H,5H-furo[3,2-c]pyridine-3-amido}benzoate

IUPAC name

ethyl 3-{5-[(4-fluorophenyl)methyl]-2-methyl-4-oxo-4H5H-furo[32-c]pyridine-3-amido}benzoate

SMILES

CCOC(c1cccc(NC(c2c(C)oc(C=CN3Cc(cc4)ccc4F)c2C3=O)=O)c1)=O

InChI

InChI=1S/C25H21FN2O5/c1-3-32-25(31)17-5-4-6-19(13-17)27-23(29)21-15(2)33-20-11-12-28(24(30)22(20)21)14-16-7-9-18(26)10-8-16/h4-13H,3,14H2,1-2H3,(H,27,29)

InChI Key

AHMRHOKNAQAGKK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27573150

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.028

Distribution Coefficient, logD

4.027

Water Solubility, LogSw

-4.21

Polar Surface Area

67.754

Acid Dissociation Constant (pKa)

10.34

Base Dissociation Constant (pKb)

-5.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

P328-1685 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with P328-1685 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P328-1685?
Check Price and Availability of P328-1685, 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 P328-1685 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P328-1685
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P328-1685
  • 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 P328-1685 available by request