5504-0235 Screening compound: N'-(2-chlorobenzenesulfonyl)-3,4-dimethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carbohydrazide

5504-0235 Screening compound: N'-(2-chlorobenzenesulfonyl)-3,4-dimethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carbohydrazide
5504-0235 Screening compound: N'-(2-chlorobenzenesulfonyl)-3,4-dimethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5504-0235
N'-(2-chlorobenzenesulfonyl)-3,4-dimethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carbohydrazide

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

5504-0235

Molecular Formula

C12H12ClN3O3S3 (C12 H12 ClN3 O3 S3)

Compound Name

N'-(2-chlorobenzenesulfonyl)-3,4-dimethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carbohydrazide

IUPAC name

N'-(2-chlorobenzenesulfonyl)-34-dimethyl-2-sulfanylidene-23-dihydro-13-thiazole-5-carbohydrazide

SMILES

CC(N1C)=C(C(NNS(c(cccc2)c2Cl)(=O)=O)=O)SC1=S

InChI

InChI=1S/C12H12ClN3O3S3/c1-7-10(21-12(20)16(7)2)11(17)14-15-22(18,19)9-6-4-3-5-8(9)13/h3-6,15H,1-2H3,(H,14,17)

InChI Key

OLSKZVQUNJPAQT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03502183

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.9

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.449

Distribution Coefficient, logD

1.449

Water Solubility, LogSw

-2.63

Polar Surface Area

69.667

Acid Dissociation Constant (pKa)

10.18

Base Dissociation Constant (pKb)

2.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

5504-0235 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 5504-0235 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5504-0235?
Check Price and Availability of 5504-0235, 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 5504-0235 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5504-0235
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5504-0235
  • 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 5504-0235 available by request