0968-0016 Screening compound: 2,2-bis(4-chlorophenyl)-N'-[4-(cyanosulfanyl)phenyl]-2-hydroxyacetohydrazide

0968-0016 Screening compound: 2,2-bis(4-chlorophenyl)-N'-[4-(cyanosulfanyl)phenyl]-2-hydroxyacetohydrazide
0968-0016 Screening compound: 2,2-bis(4-chlorophenyl)-N'-[4-(cyanosulfanyl)phenyl]-2-hydroxyacetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0968-0016
2,2-bis(4-chlorophenyl)-N'-[4-(cyanosulfanyl)phenyl]-2-hydroxyacetohydrazide

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

0968-0016

Molecular Formula

C21H15Cl2N3O2S (C21 H15 Cl2 N3 O2 S)

Compound Name

2,2-bis(4-chlorophenyl)-N'-[4-(cyanosulfanyl)phenyl]-2-hydroxyacetohydrazide

IUPAC name

22-bis(4-chlorophenyl)-N'-[4-(cyanosulfanyl)phenyl]-2-hydroxyacetohydrazide

SMILES

N#CSc(cc1)ccc1NNC(C(c(cc1)ccc1Cl)(c(cc1)ccc1Cl)O)=O

InChI

InChI=1S/C21H15Cl2N3O2S/c22-16-5-1-14(2-6-16)21(28,15-3-7-17(23)8-4-15)20(27)26-25-18-9-11-19(12-10-18)29-13-24/h1-12,25,28H,(H,26,27)

InChI Key

WVACSEKJKLGRAZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00510492

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.904

Distribution Coefficient, logD

4.897

Water Solubility, LogSw

-4.88

Polar Surface Area

69.849

Acid Dissociation Constant (pKa)

10.25

Base Dissociation Constant (pKb)

5.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

0968-0016 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0968-0016 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0968-0016?
Check Price and Availability of 0968-0016, 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 0968-0016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0968-0016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0968-0016
  • 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 0968-0016 available by request