structure of Trichlorothiazole

Trichlorothiazole

CAS No.: 50844-30-9
M. Wt: 188.46300
M. Fa: C3Cl3NS
InChI Key: FDWSIACICRBLGW-UHFFFAOYSA-N
Appearance: Colorless Liquid

Names and Identifiers of Trichlorothiazole

CAS Number

50844-30-9

EC Number

256-794-6

MDL Number

MFCD21086227

IUPAC Name

2,4,5-trichloro-1,3-thiazole

InChI

InChI=1S/C3Cl3NS/c4-1-2(5)8-3(6)7-1

InChIKey

FDWSIACICRBLGW-UHFFFAOYSA-N

Canonical SMILES

C1(=C(SC(=N1)Cl)Cl)Cl

UNSPSC Code

12352100

Physical and chemical properties of Trichlorothiazole

Boiling Point

270ºC at 760mmHg

Density

1.745g/cm3

Exact Mass

186.88200

Flash Point

117.1ºC

H Bond Acceptors

1

H Bond Donors

0

Index of Refraction

1.609

LogP

3.10330

Molecular Formula

C3Cl3NS

Molecular Weight

188.46300

PSA

41.13000

Storage condition

2-8°C

Safety Information of Trichlorothiazole

Pictograms

Signal Word

 Warning

Safety Data Sheet
Supports customized editing of SDS information and downloading in PDF documents.

Applications of Trichlorothiazole

Trichlorothiazole finds applications across various domains:

  • Agriculture: Used as a fungicide and bactericide to protect crops from fungal diseases.
  • Pharmaceuticals: Investigated for its potential anti-cancer properties and as an antimicrobial agent.
  • Chemical Intermediates: Serves as a precursor in the synthesis of other complex organic compounds.

Its unique structure allows it to participate in diverse

Interaction Studies of Trichlorothiazole

Interaction studies of trichlorothiazole have focused on its behavior in biological systems and its interactions with various enzymes and receptors. Research indicates that it can inhibit certain cytochrome P450 enzymes, which are crucial for drug metabolism. This inhibition could lead to drug-drug interactions when used alongside other pharmaceuticals.

Furthermore, studies have explored its binding affinity to various biological targets, providing insights into its mechanism of action as an antimicrobial agent.

Biological Activity of Trichlorothiazole

Trichlorothiazole exhibits notable biological activity, particularly as a fungicide and bactericide. Its mechanism of action is often linked to the inhibition of key enzymatic processes in microbial cells. Studies have shown that it can disrupt cellular functions, making it effective against various pathogens. Moreover, it has been investigated for potential use in cancer therapy due to its ability to induce apoptosis in certain cancer cell lines.