7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine

C16H9F3N4S — CID 10269117

IUPAC7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine
SMILESFC(F)(F)c1cnn2c(-c3cccc(-c4cccs4)c3)cnc2n1
InChIInChI=1S/C16H9F3N4S/c17-16(18,19)14-9-21-23-12(8-20-15(23)22-14)10-3-1-4-11(7-10)13-5-2-6-24-13/h1-9H
InChIKeyCAMGAXYEZCKUEL-UHFFFAOYSA-N
MW346.34 g/mol
LogP4.54
Rot. Bonds2

About 7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine

7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine (PubChem CID 10269117) has the molecular formula C16H9F3N4S and a molecular weight of 346.34 g/mol. Its IUPAC name is 7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine.

Molecular Properties

Compound Name7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine
PubChem CID10269117
Molecular FormulaC16H9F3N4S
Molecular Weight346.34 g/mol
Exact Mass346.05
IUPAC Name7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine
SMILESFC(F)(F)c1cnn2c(-c3cccc(-c4cccs4)c3)cnc2n1
InChIInChI=1S/C16H9F3N4S/c17-16(18,19)14-9-21-23-12(8-20-15(23)22-14)10-3-1-4-11(7-10)13-5-2-6-24-13/h1-9H
InChIKeyCAMGAXYEZCKUEL-UHFFFAOYSA-N
XLogP4.54
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.34
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine?
The IUPAC name of 7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine (CID 10269117) is 7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine.
What is the SMILES notation for 7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine?
The canonical SMILES for 7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine is FC(F)(F)c1cnn2c(-c3cccc(-c4cccs4)c3)cnc2n1.
What is the InChIKey of 7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine?
The InChIKey is CAMGAXYEZCKUEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9F3N4S/c17-16(18,19)14-9-21-23-12(8-20-15(23)22-14)10-3-1-4-11(7-10)13-5-2-6-24-13/h1-9H.
What are the key properties of 7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine?
7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine has a molecular weight of 346.34 g/mol, XLogP of 4.54, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-thiophen-2-ylphenyl)-3-(trifluoromethyl)imidazo[1,2-b][1,2,4]triazine is sourced from PubChem (CID 10269117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).