2-phenyl-4-(trifluoromethyl)-1,3-thiazole

C10H6F3NS — CID 15717200

IUPAC2-phenyl-4-(trifluoromethyl)-1,3-thiazole
SMILESFC(F)(F)c1csc(-c2ccccc2)n1
InChIInChI=1S/C10H6F3NS/c11-10(12,13)8-6-15-9(14-8)7-4-2-1-3-5-7/h1-6H
InChIKeyRUGWSEFITJJGAI-UHFFFAOYSA-N
MW229.23 g/mol
LogP3.83
Rot. Bonds1

About 2-phenyl-4-(trifluoromethyl)-1,3-thiazole

2-phenyl-4-(trifluoromethyl)-1,3-thiazole (PubChem CID 15717200) has the molecular formula C10H6F3NS and a molecular weight of 229.23 g/mol. Its IUPAC name is 2-phenyl-4-(trifluoromethyl)-1,3-thiazole.

Molecular Properties

Compound Name2-phenyl-4-(trifluoromethyl)-1,3-thiazole
PubChem CID15717200
Molecular FormulaC10H6F3NS
Molecular Weight229.23 g/mol
Exact Mass229.02
IUPAC Name2-phenyl-4-(trifluoromethyl)-1,3-thiazole
SMILESFC(F)(F)c1csc(-c2ccccc2)n1
InChIInChI=1S/C10H6F3NS/c11-10(12,13)8-6-15-9(14-8)7-4-2-1-3-5-7/h1-6H
InChIKeyRUGWSEFITJJGAI-UHFFFAOYSA-N
XLogP3.83
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.23
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-phenyl-4-(trifluoromethyl)-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-(trifluoromethyl)-1,3-thiazole?
The IUPAC name of 2-phenyl-4-(trifluoromethyl)-1,3-thiazole (CID 15717200) is 2-phenyl-4-(trifluoromethyl)-1,3-thiazole.
What is the SMILES notation for 2-phenyl-4-(trifluoromethyl)-1,3-thiazole?
The canonical SMILES for 2-phenyl-4-(trifluoromethyl)-1,3-thiazole is FC(F)(F)c1csc(-c2ccccc2)n1.
What is the InChIKey of 2-phenyl-4-(trifluoromethyl)-1,3-thiazole?
The InChIKey is RUGWSEFITJJGAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F3NS/c11-10(12,13)8-6-15-9(14-8)7-4-2-1-3-5-7/h1-6H.
What are the key properties of 2-phenyl-4-(trifluoromethyl)-1,3-thiazole?
2-phenyl-4-(trifluoromethyl)-1,3-thiazole has a molecular weight of 229.23 g/mol, XLogP of 3.83, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-(trifluoromethyl)-1,3-thiazole is sourced from PubChem (CID 15717200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).