4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole

C13H8FNS2 — CID 2810220

IUPAC4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole
SMILESFc1ccc(-c2csc(-c3cccs3)n2)cc1
InChIInChI=1S/C13H8FNS2/c14-10-5-3-9(4-6-10)11-8-17-13(15-11)12-2-1-7-16-12/h1-8H
InChIKeyQZTVFLKDZLLNDX-UHFFFAOYSA-N
MW261.35 g/mol
LogP4.68
Rot. Bonds2

About 4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole

4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole (PubChem CID 2810220) has the molecular formula C13H8FNS2 and a molecular weight of 261.35 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole.

Molecular Properties

Compound Name4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole
PubChem CID2810220
Molecular FormulaC13H8FNS2
Molecular Weight261.35 g/mol
Exact Mass261.01
IUPAC Name4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole
SMILESFc1ccc(-c2csc(-c3cccs3)n2)cc1
InChIInChI=1S/C13H8FNS2/c14-10-5-3-9(4-6-10)11-8-17-13(15-11)12-2-1-7-16-12/h1-8H
InChIKeyQZTVFLKDZLLNDX-UHFFFAOYSA-N
XLogP4.68
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole?
The IUPAC name of 4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole (CID 2810220) is 4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole.
What is the SMILES notation for 4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole?
The canonical SMILES for 4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole is Fc1ccc(-c2csc(-c3cccs3)n2)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole?
The InChIKey is QZTVFLKDZLLNDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8FNS2/c14-10-5-3-9(4-6-10)11-8-17-13(15-11)12-2-1-7-16-12/h1-8H.
What are the key properties of 4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole?
4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole has a molecular weight of 261.35 g/mol, XLogP of 4.68, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-2-thiophen-2-yl-1,3-thiazole is sourced from PubChem (CID 2810220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).