E746-0096 Screening compound: N-(2-bromo-4-methylphenyl)-4-(1H-pyrazol-1-yl)benzene-1-sulfonamide

E746-0096 Screening compound: N-(2-bromo-4-methylphenyl)-4-(1H-pyrazol-1-yl)benzene-1-sulfonamide
E746-0096 Screening compound: N-(2-bromo-4-methylphenyl)-4-(1H-pyrazol-1-yl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E746-0096
N-(2-bromo-4-methylphenyl)-4-(1H-pyrazol-1-yl)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

E746-0096

Molecular Formula

C16H14BrN3O2S (C16 H14 BrN3 O2 S)

Compound Name

N-(2-bromo-4-methylphenyl)-4-(1H-pyrazol-1-yl)benzene-1-sulfonamide

IUPAC name

N-(2-bromo-4-methylphenyl)-4-(1H-pyrazol-1-yl)benzene-1-sulfonamide

SMILES

Cc(cc1)cc(Br)c1NS(c(cc1)ccc1-n1nccc1)(=O)=O

InChI

InChI=1S/C16H14BrN3O2S/c1-12-3-8-16(15(17)11-12)19-23(21,22)14-6-4-13(5-7-14)20-10-2-9-18-20/h2-11,19H,1H3

InChI Key

OWNKWBGWJAKJHE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14914809

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.28

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.842

Distribution Coefficient, logD

3.770

Water Solubility, LogSw

-3.97

Polar Surface Area

54.565

Acid Dissociation Constant (pKa)

8.15

Base Dissociation Constant (pKb)

1.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

E746-0096 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • Pool
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 E746-0096 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E746-0096?
Check Price and Availability of E746-0096, 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 E746-0096 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E746-0096
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E746-0096
  • 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 E746-0096 available by request