4940-1444 Screening compound: 4-chloro-N'~1~-(1,1-dioxo-1H-1,2-benzisothiazol-3-yl)benzohydrazide

4940-1444 Screening compound: 4-chloro-N'~1~-(1,1-dioxo-1H-1,2-benzisothiazol-3-yl)benzohydrazide
4940-1444 Screening compound: 4-chloro-N'~1~-(1,1-dioxo-1H-1,2-benzisothiazol-3-yl)benzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4940-1444
4-chloro-N'~1~-(1,1-dioxo-1H-1,2-benzisothiazol-3-yl)benzohydrazide

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

4940-1444

Molecular Formula

C14H10ClN3O3S (C14 H10 ClN3 O3 S)

Compound Name

4-chloro-N'~1~-(1,1-dioxo-1H-1,2-benzisothiazol-3-yl)benzohydrazide

IUPAC name

4-chloro-N'-(11-dioxo-1lambda62-benzothiazol-3-yl)benzohydrazide

SMILES

O=C(c(cc1)ccc1Cl)NNC(c1c2cccc1)=NS2(=O)=O

InChI

InChI=1S/C14H10ClN3O3S/c15-10-7-5-9(6-8-10)14(19)17-16-13-11-3-1-2-4-12(11)22(20,21)18-13/h1-8H,(H,16,18)(H,17,19)

InChI Key

RKTLFUOJXIIVKG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01235056

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.77

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.859

Distribution Coefficient, logD

1.671

Water Solubility, LogSw

-3.15

Polar Surface Area

78.949

Acid Dissociation Constant (pKa)

7.67

Base Dissociation Constant (pKb)

-2.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

4940-1444 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 4940-1444 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4940-1444?
Check Price and Availability of 4940-1444, 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 4940-1444 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4940-1444
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4940-1444
  • 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 4940-1444 available by request