P327-0165 Screening compound: 3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2,5-dimethyl-4H,5H-thieno[3,2-c]pyridin-4-one

P327-0165 Screening compound: 3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2,5-dimethyl-4H,5H-thieno[3,2-c]pyridin-4-one
P327-0165 Screening compound: 3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2,5-dimethyl-4H,5H-thieno[3,2-c]pyridin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P327-0165
3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2,5-dimethyl-4H,5H-thieno[3,2-c]pyridin-4-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

P327-0165

Molecular Formula

C20H20FN3O2S (C20 H20 FN3 O2 S)

Compound Name

3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2,5-dimethyl-4H,5H-thieno[3,2-c]pyridin-4-one

IUPAC name

3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-25-dimethyl-4H5H-thieno[32-c]pyridin-4-one

SMILES

Cc1c(C(N(CC2)CCN2c(cc2)ccc2F)=O)c(C(N(C)C=C2)=O)c2s1

InChI

InChI=1S/C20H20FN3O2S/c1-13-17(18-16(27-13)7-8-22(2)19(18)25)20(26)24-11-9-23(10-12-24)15-5-3-14(21)4-6-15/h3-8H,9-12H2,1-2H3

InChI Key

LLEFLRNUUIWXNY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29020934

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.285

Distribution Coefficient, logD

2.285

Water Solubility, LogSw

-2.52

Polar Surface Area

36.595

Acid Dissociation Constant (pKa)

28.00

Base Dissociation Constant (pKb)

1.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

P327-0165 in Drug Discovery

Included in Screening Libraries

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

SmartTM Library (51161 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with P327-0165 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P327-0165?
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What is the minimum amount of P327-0165 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P327-0165
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P327-0165
  • 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 P327-0165 available by request