P314-0771 Screening compound: 3-cyano-N-[1-(4-fluorophenyl)-2-oxopyrrolidin-3-yl]benzamide

P314-0771 Screening compound: 3-cyano-N-[1-(4-fluorophenyl)-2-oxopyrrolidin-3-yl]benzamide
P314-0771 Screening compound: 3-cyano-N-[1-(4-fluorophenyl)-2-oxopyrrolidin-3-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P314-0771
3-cyano-N-[1-(4-fluorophenyl)-2-oxopyrrolidin-3-yl]benzamide

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

P314-0771

Molecular Formula

C18H14FN3O2 (C18 H14 FN3 O2)

Compound Name

3-cyano-N-[1-(4-fluorophenyl)-2-oxopyrrolidin-3-yl]benzamide

IUPAC name

3-cyano-N-[1-(4-fluorophenyl)-2-oxopyrrolidin-3-yl]benzamide

SMILES

N#Cc1cccc(C(NC(CCN2c(cc3)ccc3F)C2=O)=O)c1

InChI

InChI=1S/C18H14FN3O2/c19-14-4-6-15(7-5-14)22-9-8-16(18(22)24)21-17(23)13-3-1-2-12(10-13)11-20/h1-7,10,16H,8-9H2,(H,21,23)/t16-/m1/s1

InChI Key

HJPCEXGGKOIEBW-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD27571729

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.950

Distribution Coefficient, logD

1.949

Water Solubility, LogSw

-2.40

Polar Surface Area

58.170

Acid Dissociation Constant (pKa)

10.03

Base Dissociation Constant (pKb)

-2.66

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

P314-0771 in Drug Discovery

Included in Screening Libraries

RAR (Nuclear receptors) Ligands Library (6524 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with P314-0771 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P314-0771?
Check Price and Availability of P314-0771, 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 P314-0771 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P314-0771
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P314-0771
  • 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 P314-0771 available by request