0180-0368 Screening compound: 2-[(2,6-dichloro-4-nitrophenyl)sulfanyl]-1,3-benzothiazole

0180-0368 Screening compound: 2-[(2,6-dichloro-4-nitrophenyl)sulfanyl]-1,3-benzothiazole
0180-0368 Screening compound: 2-[(2,6-dichloro-4-nitrophenyl)sulfanyl]-1,3-benzothiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 0180-0368
2-[(2,6-dichloro-4-nitrophenyl)sulfanyl]-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

0180-0368

Molecular Formula

C13H6Cl2N2O2S2 (C13 H6 Cl2 N2 O2 S2)

Compound Name

2-[(2,6-dichloro-4-nitrophenyl)sulfanyl]-1,3-benzothiazole

IUPAC name

2-[(26-dichloro-4-nitrophenyl)sulfanyl]-13-benzothiazole

SMILES

[O-][N+](c(cc1Cl)cc(Cl)c1Sc1nc(cccc2)c2s1)=O

InChI

InChI=1S/C13H6Cl2N2O2S2/c14-8-5-7(17(18)19)6-9(15)12(8)21-13-16-10-3-1-2-4-11(10)20-13/h1-6H

InChI Key

FVALGSRUTPLHFU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00552819

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.24

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.315

Distribution Coefficient, logD

5.315

Water Solubility, LogSw

-6.08

Polar Surface Area

42.430

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0180-0368 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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 0180-0368 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0180-0368?
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What is the minimum amount of 0180-0368 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0180-0368
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0180-0368
  • 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 0180-0368 available by request