4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole

C12H8N2OS — CID 2562136

IUPAC4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole
SMILESc1ccc(-c2nc(-c3ccco3)cs2)nc1
InChIInChI=1S/C12H8N2OS/c1-2-6-13-9(4-1)12-14-10(8-16-12)11-5-3-7-15-11/h1-8H
InChIKeyWNAWCLPPKDFKIK-UHFFFAOYSA-N
MW228.28 g/mol
LogP3.47
Rot. Bonds2

About 4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole

4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole (PubChem CID 2562136) has the molecular formula C12H8N2OS and a molecular weight of 228.28 g/mol. Its IUPAC name is 4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole.

Molecular Properties

Compound Name4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole
PubChem CID2562136
Molecular FormulaC12H8N2OS
Molecular Weight228.28 g/mol
Exact Mass228.04
IUPAC Name4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole
SMILESc1ccc(-c2nc(-c3ccco3)cs2)nc1
InChIInChI=1S/C12H8N2OS/c1-2-6-13-9(4-1)12-14-10(8-16-12)11-5-3-7-15-11/h1-8H
InChIKeyWNAWCLPPKDFKIK-UHFFFAOYSA-N
XLogP3.47
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.28
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole 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 4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole?
The IUPAC name of 4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole (CID 2562136) is 4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole.
What is the SMILES notation for 4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole?
The canonical SMILES for 4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole is c1ccc(-c2nc(-c3ccco3)cs2)nc1.
What is the InChIKey of 4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole?
The InChIKey is WNAWCLPPKDFKIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N2OS/c1-2-6-13-9(4-1)12-14-10(8-16-12)11-5-3-7-15-11/h1-8H.
What are the key properties of 4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole?
4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole has a molecular weight of 228.28 g/mol, XLogP of 3.47, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-2-pyridin-2-yl-1,3-thiazole is sourced from PubChem (CID 2562136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).