2712-0193 Screening compound: N-(4-methylbenzenesulfonyl)-N-{4-[N-(4-methylbenzenesulfonyl)benzamido]phenyl}benzamide

2712-0193 Screening compound: N-(4-methylbenzenesulfonyl)-N-{4-[N-(4-methylbenzenesulfonyl)benzamido]phenyl}benzamide
2712-0193 Screening compound: N-(4-methylbenzenesulfonyl)-N-{4-[N-(4-methylbenzenesulfonyl)benzamido]phenyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2712-0193
N-(4-methylbenzenesulfonyl)-N-{4-[N-(4-methylbenzenesulfonyl)benzamido]phenyl}benzamide

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

2712-0193

Molecular Formula

C34H28N2O6S2 (C34 H28 N2 O6 S2)

Compound Name

N-(4-methylbenzenesulfonyl)-N-{4-[N-(4-methylbenzenesulfonyl)benzamido]phenyl}benzamide

IUPAC name

N-(4-methylbenzenesulfonyl)-N-{4-[N-(4-methylbenzenesulfonyl)benzamido]phenyl}benzamide

SMILES

Cc(cc1)ccc1S(N(C(c1ccccc1)=O)c(cc1)ccc1N(C(c1ccccc1)=O)S(c1ccc(C)cc1)(=O)=O)(=O)=O

InChI

InChI=1S/C34H28N2O6S2/c1-25-13-21-31(22-14-25)43(39,40)35(33(37)27-9-5-3-6-10-27)29-17-19-30(20-18-29)36(34(38)28-11-7-4-8-12-28)44(41,42)32-23-15-26(2)16-24-32/h3-24H,1-2H3

InChI Key

OQRYVUITEYIHIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00521768

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

624.74

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.376

Distribution Coefficient, logD

6.376

Water Solubility, LogSw

-5.71

Polar Surface Area

90.854

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

-14.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

2712-0193 in Drug Discovery

Included in Screening Libraries

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 2712-0193 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2712-0193?
Check Price and Availability of 2712-0193, 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 2712-0193 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2712-0193
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2712-0193
  • 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 2712-0193 available by request