2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole

C5H2F3N3S — CID 69032394

IUPAC2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole
SMILESFC(F)(F)c1nc2sccn2n1
InChIInChI=1S/C5H2F3N3S/c6-5(7,8)3-9-4-11(10-3)1-2-12-4/h1-2H
InChIKeyLWJRZXUXNJEBDB-UHFFFAOYSA-N
MW193.15 g/mol
LogP1.81
Rot. Bonds

About 2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole

2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole (PubChem CID 69032394) has the molecular formula C5H2F3N3S and a molecular weight of 193.15 g/mol. Its IUPAC name is 2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole.

Molecular Properties

Compound Name2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole
PubChem CID69032394
Molecular FormulaC5H2F3N3S
Molecular Weight193.15 g/mol
Exact Mass192.99
IUPAC Name2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole
SMILESFC(F)(F)c1nc2sccn2n1
InChIInChI=1S/C5H2F3N3S/c6-5(7,8)3-9-4-11(10-3)1-2-12-4/h1-2H
InChIKeyLWJRZXUXNJEBDB-UHFFFAOYSA-N
XLogP1.81
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.15
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Thiazolo[3,2-b][1,2,4]triazole
CID 13755997
[1,2,3,4]Tetrazolo[5,1-B][1,3]thiazole
CID 21780996
Thiazolo[2,3-c]-1,2,4-triazole
CID 13755998
2-(Trifluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole
CID 68314856
2-(Difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole
CID 172788002
2-Methyl-[1,3]thiazolo[3,2-b][1,2,4]triazole
CID 14929653
Thiazol-2-yl-2,5-dimethyl tetrazolium bromide
CID 129821037
Thiazolo[2,3-e][1,2,4,3]triazaphosphole
CID 129860303
[1,3]Thiazolo[3,2-b][1,2,4]triazole-2-sulfonyl chloride
CID 19828957
1-Methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-1-ium
CID 67843224
Imidazo[5,1-b][1,3,4]thiadiazole
CID 69487822
3-Methyl-[1,3]thiazolo[2,3-c][1,2,4]triazole
CID 83381528

Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole?
The IUPAC name of 2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole (CID 69032394) is 2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole.
What is the SMILES notation for 2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole?
The canonical SMILES for 2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole is FC(F)(F)c1nc2sccn2n1.
What is the InChIKey of 2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole?
The InChIKey is LWJRZXUXNJEBDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H2F3N3S/c6-5(7,8)3-9-4-11(10-3)1-2-12-4/h1-2H.
What are the key properties of 2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole?
2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole has a molecular weight of 193.15 g/mol, XLogP of 1.81, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole is sourced from PubChem (CID 69032394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).