C050-0324 Screening compound: 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate

C050-0324 Screening compound: 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate
C050-0324 Screening compound: 5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C050-0324
5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate

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

C050-0324

Molecular Formula

C14H10FN3O4S2 (C14 H10 FN3 O4 S2)

Compound Name

5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate

IUPAC name

5-amino-1-(4-fluorobenzenesulfonyl)-1H-pyrazol-3-yl thiophene-2-carboxylate

SMILES

Nc1cc(OC(c2cccs2)=O)nn1S(c(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C14H10FN3O4S2/c15-9-3-5-10(6-4-9)24(20,21)18-12(16)8-13(17-18)22-14(19)11-2-1-7-23-11/h1-8H,16H2

InChI Key

ZRIJPAGIEYUEPM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04453808

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.38

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.326

Distribution Coefficient, logD

2.326

Water Solubility, LogSw

-2.90

Polar Surface Area

81.764

Acid Dissociation Constant (pKa)

18.17

Base Dissociation Constant (pKb)

-5.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

C050-0324 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

Human Proteases Annotated Library (2868 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Nervous system
Targets:
  • Kinases
  • Ion Channels
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C050-0324 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C050-0324?
Check Price and Availability of C050-0324, 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 C050-0324 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C050-0324
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C050-0324
  • 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 C050-0324 available by request