5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole

C16H10F3N5OS — CID 8681628

IUPAC5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole
SMILESFC(F)(F)c1cccc(-c2nnn(Cc3cc(-c4cccs4)on3)n2)c1
InChIInChI=1S/C16H10F3N5OS/c17-16(18,19)11-4-1-3-10(7-11)15-20-23-24(21-15)9-12-8-13(25-22-12)14-5-2-6-26-14/h1-8H,9H2
InChIKeyZGSUPLGDWBLENJ-UHFFFAOYSA-N
MW377.35 g/mol
LogP4.12
Rot. Bonds4

About 5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole

5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole (PubChem CID 8681628) has the molecular formula C16H10F3N5OS and a molecular weight of 377.35 g/mol. Its IUPAC name is 5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole.

Molecular Properties

Compound Name5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole
PubChem CID8681628
Molecular FormulaC16H10F3N5OS
Molecular Weight377.35 g/mol
Exact Mass377.06
IUPAC Name5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole
SMILESFC(F)(F)c1cccc(-c2nnn(Cc3cc(-c4cccs4)on3)n2)c1
InChIInChI=1S/C16H10F3N5OS/c17-16(18,19)11-4-1-3-10(7-11)15-20-23-24(21-15)9-12-8-13(25-22-12)14-5-2-6-26-14/h1-8H,9H2
InChIKeyZGSUPLGDWBLENJ-UHFFFAOYSA-N
XLogP4.12
TPSA69.63 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.35
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole 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 5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole?
The IUPAC name of 5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole (CID 8681628) is 5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole.
What is the SMILES notation for 5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole?
The canonical SMILES for 5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole is FC(F)(F)c1cccc(-c2nnn(Cc3cc(-c4cccs4)on3)n2)c1.
What is the InChIKey of 5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole?
The InChIKey is ZGSUPLGDWBLENJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F3N5OS/c17-16(18,19)11-4-1-3-10(7-11)15-20-23-24(21-15)9-12-8-13(25-22-12)14-5-2-6-26-14/h1-8H,9H2.
What are the key properties of 5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole?
5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole has a molecular weight of 377.35 g/mol, XLogP of 4.12, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-thiophen-2-yl-3-[[5-[3-(trifluoromethyl)phenyl]tetrazol-2-yl]methyl]-1,2-oxazole is sourced from PubChem (CID 8681628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).