5-phenyl-[1,3]thiazolo[5,4-b]pyridine

C12H8N2S — CID 141167515

IUPAC5-phenyl-[1,3]thiazolo[5,4-b]pyridine
SMILESc1ccc(-c2ccc3ncsc3n2)cc1
InChIInChI=1S/C12H8N2S/c1-2-4-9(5-3-1)10-6-7-11-12(14-10)15-8-13-11/h1-8H
InChIKeyAJNVEMDPBOWJKX-UHFFFAOYSA-N
MW212.28 g/mol
LogP3.36
Rot. Bonds1

About 5-phenyl-[1,3]thiazolo[5,4-b]pyridine

5-phenyl-[1,3]thiazolo[5,4-b]pyridine (PubChem CID 141167515) has the molecular formula C12H8N2S and a molecular weight of 212.28 g/mol. Its IUPAC name is 5-phenyl-[1,3]thiazolo[5,4-b]pyridine.

Molecular Properties

Compound Name5-phenyl-[1,3]thiazolo[5,4-b]pyridine
PubChem CID141167515
Molecular FormulaC12H8N2S
Molecular Weight212.28 g/mol
Exact Mass212.04
IUPAC Name5-phenyl-[1,3]thiazolo[5,4-b]pyridine
SMILESc1ccc(-c2ccc3ncsc3n2)cc1
InChIInChI=1S/C12H8N2S/c1-2-4-9(5-3-1)10-6-7-11-12(14-10)15-8-13-11/h1-8H
InChIKeyAJNVEMDPBOWJKX-UHFFFAOYSA-N
XLogP3.36
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.28
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-phenyl-[1,3]thiazolo[5,4-b]pyridine 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-phenyl-[1,3]thiazolo[5,4-b]pyridine?
The IUPAC name of 5-phenyl-[1,3]thiazolo[5,4-b]pyridine (CID 141167515) is 5-phenyl-[1,3]thiazolo[5,4-b]pyridine.
What is the SMILES notation for 5-phenyl-[1,3]thiazolo[5,4-b]pyridine?
The canonical SMILES for 5-phenyl-[1,3]thiazolo[5,4-b]pyridine is c1ccc(-c2ccc3ncsc3n2)cc1.
What is the InChIKey of 5-phenyl-[1,3]thiazolo[5,4-b]pyridine?
The InChIKey is AJNVEMDPBOWJKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N2S/c1-2-4-9(5-3-1)10-6-7-11-12(14-10)15-8-13-11/h1-8H.
What are the key properties of 5-phenyl-[1,3]thiazolo[5,4-b]pyridine?
5-phenyl-[1,3]thiazolo[5,4-b]pyridine has a molecular weight of 212.28 g/mol, XLogP of 3.36, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-[1,3]thiazolo[5,4-b]pyridine is sourced from PubChem (CID 141167515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).