C261-0124 Screening compound: N-(2-chloro-4-methylphenyl)-2-phenyl-1H-1,3-benzodiazole-5-sulfonamide

C261-0124 Screening compound: N-(2-chloro-4-methylphenyl)-2-phenyl-1H-1,3-benzodiazole-5-sulfonamide
C261-0124 Screening compound: N-(2-chloro-4-methylphenyl)-2-phenyl-1H-1,3-benzodiazole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C261-0124
N-(2-chloro-4-methylphenyl)-2-phenyl-1H-1,3-benzodiazole-5-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

C261-0124

Molecular Formula

C20H16ClN3O2S (C20 H16 ClN3 O2 S)

Compound Name

N-(2-chloro-4-methylphenyl)-2-phenyl-1H-1,3-benzodiazole-5-sulfonamide

IUPAC name

N-(2-chloro-4-methylphenyl)-2-phenyl-1H-13-benzodiazole-5-sulfonamide

SMILES

Cc(cc1)cc(Cl)c1NS(c(cc1)cc2c1[nH]c(-c1ccccc1)n2)(=O)=O

InChI

InChI=1S/C20H16ClN3O2S/c1-13-7-9-17(16(21)11-13)24-27(25,26)15-8-10-18-19(12-15)23-20(22-18)14-5-3-2-4-6-14/h2-12,24H,1H3,(H,22,23)

InChI Key

YVBBPHXIZHSWIU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14739214

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.88

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.160

Distribution Coefficient, logD

4.331

Water Solubility, LogSw

-5.77

Polar Surface Area

59.210

Acid Dissociation Constant (pKa)

6.64

Base Dissociation Constant (pKb)

5.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

C261-0124 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anticancer Library (62698 compounds)

CNS targets activity set (6557 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:
  • Cancer

References: we are preparing a list of scientific research reports with C261-0124 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C261-0124?
Check Price and Availability of C261-0124, 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 C261-0124 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C261-0124
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C261-0124
  • 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 C261-0124 available by request