8009-9434 Screening compound: 2-[4-(4-methylbenzenesulfonyl)piperazin-1-yl]-1,3-benzothiazole

8009-9434 Screening compound: 2-[4-(4-methylbenzenesulfonyl)piperazin-1-yl]-1,3-benzothiazole
8009-9434 Screening compound: 2-[4-(4-methylbenzenesulfonyl)piperazin-1-yl]-1,3-benzothiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-9434
2-[4-(4-methylbenzenesulfonyl)piperazin-1-yl]-1,3-benzothiazole

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

8009-9434

Molecular Formula

C18H19N3O2S2 (C18 H19 N3 O2 S2)

Compound Name

2-[4-(4-methylbenzenesulfonyl)piperazin-1-yl]-1,3-benzothiazole

IUPAC name

2-[4-(4-methylbenzenesulfonyl)piperazin-1-yl]-13-benzothiazole

SMILES

Cc(cc1)ccc1S(N(CC1)CCN1c1nc(cccc2)c2s1)(=O)=O

InChI

InChI=1S/C18H19N3O2S2/c1-14-6-8-15(9-7-14)25(22,23)21-12-10-20(11-13-21)18-19-16-4-2-3-5-17(16)24-18/h2-9H,10-13H2,1H3

InChI Key

IWUMRGAIJYASLP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01626226

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.319

Distribution Coefficient, logD

4.319

Water Solubility, LogSw

-4.23

Polar Surface Area

44.745

Acid Dissociation Constant (pKa)

23.49

Base Dissociation Constant (pKb)

2.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

8009-9434 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Dark Chemical Matter Library (18430 compounds)

GPCR Targeted Library (31838 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Agro:
  • Agro
Structure:
  • Pool
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8009-9434 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-9434?
Check Price and Availability of 8009-9434, 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 8009-9434 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-9434
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-9434
  • 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 8009-9434 available by request