0975-0039 Screening compound: 2-hydroxy-N'-(4-methylbenzenesulfonyl)-2,2-diphenylacetohydrazide

0975-0039 Screening compound: 2-hydroxy-N'-(4-methylbenzenesulfonyl)-2,2-diphenylacetohydrazide
0975-0039 Screening compound: 2-hydroxy-N'-(4-methylbenzenesulfonyl)-2,2-diphenylacetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0975-0039
2-hydroxy-N'-(4-methylbenzenesulfonyl)-2,2-diphenylacetohydrazide

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

0975-0039

Molecular Formula

C21H20N2O4S (C21 H20 N2 O4 S)

Compound Name

2-hydroxy-N'-(4-methylbenzenesulfonyl)-2,2-diphenylacetohydrazide

IUPAC name

2-hydroxy-N'-(4-methylbenzenesulfonyl)-22-diphenylacetohydrazide

SMILES

Cc(cc1)ccc1S(NNC(C(c1ccccc1)(c1ccccc1)O)=O)(=O)=O

InChI

InChI=1S/C21H20N2O4S/c1-16-12-14-19(15-13-16)28(26,27)23-22-20(24)21(25,17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15,23,25H,1H3,(H,22,24)

InChI Key

XQQFQCNVJHSEHB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00138052

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.671

Distribution Coefficient, logD

2.671

Water Solubility, LogSw

-3.11

Polar Surface Area

81.505

Acid Dissociation Constant (pKa)

10.18

Base Dissociation Constant (pKb)

-4.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

0975-0039 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Dark Chemical Matter Library (18430 compounds)

Eccentric PPI Library (11937 compounds)

Frequent Hitters Library (7624 compounds)

Human GPCR Annotated Library (5539 compounds)

Protein-Protein Interaction Library (218420 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Kinases
  • Phosphatases
Structure:
  • Pool
  • Cyclic compounds
  • Pool
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0975-0039 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0975-0039?
Check Price and Availability of 0975-0039, 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 0975-0039 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0975-0039
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0975-0039
  • 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 0975-0039 available by request