2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole

C12H8F3N3S — CID 107646639

IUPAC2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole
SMILESCc1nn2cc(-c3ccccc3C(F)(F)F)nc2s1
InChIInChI=1S/C12H8F3N3S/c1-7-17-18-6-10(16-11(18)19-7)8-4-2-3-5-9(8)12(13,14)15/h2-6H,1H3
InChIKeyYWGAOBQKPHCFNT-UHFFFAOYSA-N
MW283.28 g/mol
LogP3.79
Rot. Bonds1

About 2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole

2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole (PubChem CID 107646639) has the molecular formula C12H8F3N3S and a molecular weight of 283.28 g/mol. Its IUPAC name is 2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole.

Molecular Properties

Compound Name2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole
PubChem CID107646639
Molecular FormulaC12H8F3N3S
Molecular Weight283.28 g/mol
Exact Mass283.04
IUPAC Name2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole
SMILESCc1nn2cc(-c3ccccc3C(F)(F)F)nc2s1
InChIInChI=1S/C12H8F3N3S/c1-7-17-18-6-10(16-11(18)19-7)8-4-2-3-5-9(8)12(13,14)15/h2-6H,1H3
InChIKeyYWGAOBQKPHCFNT-UHFFFAOYSA-N
XLogP3.79
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.28
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole with MolForge

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

Launch Full Analysis

Related Compounds

6-(3-fluorophenyl)-2-methylimidazo[2,1-b][1,3,4]thiadiazole
CID 107646686
2-[2-(trifluoromethyl)phenyl]-1,3-benzothiazole
CID 1214783
6-(3-bromo-4-fluorophenyl)-2-methylimidazo[2,1-b][1,3,4]thiadiazole
CID 107646691
6-(5-bromofuran-2-yl)-2-methylimidazo[2,1-b][1,3,4]thiadiazole
CID 107646529
6-bromo-8-methyl-2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine
CID 83169792
4-methoxy-2,6-bis[2-(trifluoromethyl)phenyl]pyridine
CID 134618215
2-methyl-6-(4-nitrophenyl)imidazo[2,1-b][1,3,4]thiadiazole
CID 4173731
[2-methyl-5-[2-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidin-3-yl]carbamic acid
CID 123391936
1-(trifluoromethyl)-2-[2-(trifluoromethyl)phenyl]benzene
CID 3013906
2-methyl-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxylic acid
CID 112694386
[2-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-8-yl]methanamine
CID 117137631
2,5-dimethyl-N-[2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[1,2-b]pyridazin-3-yl]-1,3-thiazole-4-carboxamide
CID 71525675

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole?
The IUPAC name of 2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole (CID 107646639) is 2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole.
What is the SMILES notation for 2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole?
The canonical SMILES for 2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole is Cc1nn2cc(-c3ccccc3C(F)(F)F)nc2s1.
What is the InChIKey of 2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole?
The InChIKey is YWGAOBQKPHCFNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8F3N3S/c1-7-17-18-6-10(16-11(18)19-7)8-4-2-3-5-9(8)12(13,14)15/h2-6H,1H3.
What are the key properties of 2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole?
2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole has a molecular weight of 283.28 g/mol, XLogP of 3.79, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[2-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3,4]thiadiazole is sourced from PubChem (CID 107646639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).