2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine

C20H12N4S2 — CID 123407253

IUPAC2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine
SMILESc1ccc(-c2cc3ccc(-c4cnc(-c5cccnc5)s4)nc3s2)nc1
InChIInChI=1S/C20H12N4S2/c1-2-9-22-15(5-1)17-10-13-6-7-16(24-20(13)25-17)18-12-23-19(26-18)14-4-3-8-21-11-14/h1-12H
InChIKeyPFXIASROAYBFOG-UHFFFAOYSA-N
MW372.48 g/mol
LogP5.54
Rot. Bonds3

About 2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine

2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine (PubChem CID 123407253) has the molecular formula C20H12N4S2 and a molecular weight of 372.48 g/mol. Its IUPAC name is 2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine.

Molecular Properties

Compound Name2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine
PubChem CID123407253
Molecular FormulaC20H12N4S2
Molecular Weight372.48 g/mol
Exact Mass372.05
IUPAC Name2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine
SMILESc1ccc(-c2cc3ccc(-c4cnc(-c5cccnc5)s4)nc3s2)nc1
InChIInChI=1S/C20H12N4S2/c1-2-9-22-15(5-1)17-10-13-6-7-16(24-20(13)25-17)18-12-23-19(26-18)14-4-3-8-21-11-14/h1-12H
InChIKeyPFXIASROAYBFOG-UHFFFAOYSA-N
XLogP5.54
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.48
LogP ≤ 55.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-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 2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine?
The IUPAC name of 2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine (CID 123407253) is 2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine.
What is the SMILES notation for 2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine?
The canonical SMILES for 2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine is c1ccc(-c2cc3ccc(-c4cnc(-c5cccnc5)s4)nc3s2)nc1.
What is the InChIKey of 2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine?
The InChIKey is PFXIASROAYBFOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12N4S2/c1-2-9-22-15(5-1)17-10-13-6-7-16(24-20(13)25-17)18-12-23-19(26-18)14-4-3-8-21-11-14/h1-12H.
What are the key properties of 2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine?
2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine has a molecular weight of 372.48 g/mol, XLogP of 5.54, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-yl-6-(2-pyridin-3-yl-1,3-thiazol-5-yl)thieno[2,3-b]pyridine is sourced from PubChem (CID 123407253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).