P898-0232 Screening compound: N-(2-fluoro-5-methylphenyl)-5-[4-(piperidine-1-carbonyl)-1H-pyrazol-5-yl]furan-2-sulfonamide

P898-0232 Screening compound: N-(2-fluoro-5-methylphenyl)-5-[4-(piperidine-1-carbonyl)-1H-pyrazol-5-yl]furan-2-sulfonamide
P898-0232 Screening compound: N-(2-fluoro-5-methylphenyl)-5-[4-(piperidine-1-carbonyl)-1H-pyrazol-5-yl]furan-2-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P898-0232
N-(2-fluoro-5-methylphenyl)-5-[4-(piperidine-1-carbonyl)-1H-pyrazol-5-yl]furan-2-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

P898-0232

Molecular Formula

C20H21FN4O4S (C20 H21 FN4 O4 S)

Compound Name

N-(2-fluoro-5-methylphenyl)-5-[4-(piperidine-1-carbonyl)-1H-pyrazol-5-yl]furan-2-sulfonamide

IUPAC name

N-(2-fluoro-5-methylphenyl)-5-[4-(piperidine-1-carbonyl)-1H-pyrazol-5-yl]furan-2-sulfonamide

SMILES

Cc(cc1)cc(NS(c2ccc(-c([nH]nc3)c3C(N3CCCCC3)=O)o2)(=O)=O)c1F

InChI

InChI=1S/C20H21FN4O4S/c1-13-5-6-15(21)16(11-13)24-30(27,28)18-8-7-17(29-18)19-14(12-22-23-19)20(26)25-9-3-2-4-10-25/h5-8,11-12,24H,2-4,9-10H2,1H3,(H,22,23)

InChI Key

BNIKTNLZOUKWTK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29027434

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.236

Distribution Coefficient, logD

2.389

Water Solubility, LogSw

-3.43

Polar Surface Area

89.920

Acid Dissociation Constant (pKa)

6.62

Base Dissociation Constant (pKb)

2.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

P898-0232 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 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 P898-0232 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P898-0232?
Check Price and Availability of P898-0232, 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 P898-0232 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P898-0232
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P898-0232
  • 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 P898-0232 available by request