E746-0045 Screening compound: N-(2,3-dimethylphenyl)-4-(1H-pyrazol-1-yl)benzene-1-sulfonamide

E746-0045 Screening compound: N-(2,3-dimethylphenyl)-4-(1H-pyrazol-1-yl)benzene-1-sulfonamide
E746-0045 Screening compound: N-(2,3-dimethylphenyl)-4-(1H-pyrazol-1-yl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E746-0045
N-(2,3-dimethylphenyl)-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

E746-0045

Molecular Formula

C17H17N3O2S (C17 H17 N3 O2 S)

Compound Name

N-(2,3-dimethylphenyl)-4-(1H-pyrazol-1-yl)benzene-1-sulfonamide

IUPAC name

N-(23-dimethylphenyl)-4-(1H-pyrazol-1-yl)benzene-1-sulfonamide

SMILES

Cc1cccc(NS(c(cc2)ccc2-n2nccc2)(=O)=O)c1C

InChI

InChI=1S/C17H17N3O2S/c1-13-5-3-6-17(14(13)2)19-23(21,22)16-9-7-15(8-10-16)20-12-4-11-18-20/h3-12,19H,1-2H3

InChI Key

CLIHLQAQEWIWFR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14914789

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.41

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

3.708

Distribution Coefficient, logD

3.701

Water Solubility, LogSw

-3.97

Polar Surface Area

54.565

Acid Dissociation Constant (pKa)

9.19

Base Dissociation Constant (pKb)

1.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

E746-0045 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Nucleic Acid Ligands (8311 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with E746-0045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E746-0045?
Check Price and Availability of E746-0045, 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 E746-0045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E746-0045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E746-0045
  • 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 E746-0045 available by request