P316-0442 Screening compound: N-[1-(4-fluorophenyl)-2-oxopyrrolidin-3-yl]-3-(trifluoromethyl)benzene-1-sulfonamide

P316-0442 Screening compound: N-[1-(4-fluorophenyl)-2-oxopyrrolidin-3-yl]-3-(trifluoromethyl)benzene-1-sulfonamide
P316-0442 Screening compound: N-[1-(4-fluorophenyl)-2-oxopyrrolidin-3-yl]-3-(trifluoromethyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P316-0442
N-[1-(4-fluorophenyl)-2-oxopyrrolidin-3-yl]-3-(trifluoromethyl)benzene-1-sulfonamide

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

P316-0442

Molecular Formula

C17H14F4N2O3S (C17 H14 F4 N2 O3 S)

Compound Name

N-[1-(4-fluorophenyl)-2-oxopyrrolidin-3-yl]-3-(trifluoromethyl)benzene-1-sulfonamide

IUPAC name

N-[1-(4-fluorophenyl)-2-oxopyrrolidin-3-yl]-3-(trifluoromethyl)benzene-1-sulfonamide

SMILES

O=C(C(CC1)NS(c2cc(C(F)(F)F)ccc2)(=O)=O)N1c(cc1)ccc1F

InChI

InChI=1S/C17H14F4N2O3S/c18-12-4-6-13(7-5-12)23-9-8-15(16(23)24)22-27(25,26)14-3-1-2-11(10-14)17(19,20)21/h1-7,10,15,22H,8-9H2/t15-/m0/s1

InChI Key

KGYZYUMEJJOMHP-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD27572392

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.360

Distribution Coefficient, logD

3.359

Water Solubility, LogSw

-3.73

Polar Surface Area

58.672

Acid Dissociation Constant (pKa)

10.66

Base Dissociation Constant (pKb)

-4.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.50

P316-0442 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with P316-0442 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P316-0442?
Check Price and Availability of P316-0442, 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 P316-0442 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P316-0442
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P316-0442
  • 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 P316-0442 available by request