2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine

C10H5N5S2 — CID 141168083

IUPAC2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine
SMILESC1=NC2=NC(c3nc4cccnc4s3)SC2=N1
InChIInChI=1S/C10H5N5S2/c1-2-5-7(11-3-1)16-9(14-5)10-15-6-8(17-10)13-4-12-6/h1-4,10H
InChIKeyYQVJIUSJQXIWAH-UHFFFAOYSA-N
MW259.32 g/mol
LogP2.28
Rot. Bonds1

About 2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine

2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine (PubChem CID 141168083) has the molecular formula C10H5N5S2 and a molecular weight of 259.32 g/mol. Its IUPAC name is 2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine.

Molecular Properties

Compound Name2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine
PubChem CID141168083
Molecular FormulaC10H5N5S2
Molecular Weight259.32 g/mol
Exact Mass259.00
IUPAC Name2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine
SMILESC1=NC2=NC(c3nc4cccnc4s3)SC2=N1
InChIInChI=1S/C10H5N5S2/c1-2-5-7(11-3-1)16-9(14-5)10-15-6-8(17-10)13-4-12-6/h1-4,10H
InChIKeyYQVJIUSJQXIWAH-UHFFFAOYSA-N
XLogP2.28
TPSA62.86 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine?
The IUPAC name of 2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine (CID 141168083) is 2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine.
What is the SMILES notation for 2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine?
The canonical SMILES for 2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine is C1=NC2=NC(c3nc4cccnc4s3)SC2=N1.
What is the InChIKey of 2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine?
The InChIKey is YQVJIUSJQXIWAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5N5S2/c1-2-5-7(11-3-1)16-9(14-5)10-15-6-8(17-10)13-4-12-6/h1-4,10H.
What are the key properties of 2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine?
2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine has a molecular weight of 259.32 g/mol, XLogP of 2.28, 1 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2H-imidazo[4,5-d][1,3]thiazol-2-yl)-[1,3]thiazolo[5,4-b]pyridine is sourced from PubChem (CID 141168083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).