2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole

C9H5ClN2S2 — CID 10377022

IUPAC2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole
SMILESClc1cn2cc(-c3cccs3)nc2s1
InChIInChI=1S/C9H5ClN2S2/c10-8-5-12-4-6(11-9(12)14-8)7-2-1-3-13-7/h1-5H
InChIKeyKKKWUQLBZLCWLN-UHFFFAOYSA-N
MW240.74 g/mol
LogP3.78
Rot. Bonds1

About 2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole

2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole (PubChem CID 10377022) has the molecular formula C9H5ClN2S2 and a molecular weight of 240.74 g/mol. Its IUPAC name is 2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole
PubChem CID10377022
Molecular FormulaC9H5ClN2S2
Molecular Weight240.74 g/mol
Exact Mass239.96
IUPAC Name2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole
SMILESClc1cn2cc(-c3cccs3)nc2s1
InChIInChI=1S/C9H5ClN2S2/c10-8-5-12-4-6(11-9(12)14-8)7-2-1-3-13-7/h1-5H
InChIKeyKKKWUQLBZLCWLN-UHFFFAOYSA-N
XLogP3.78
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.74
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole (CID 10377022) is 2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole is Clc1cn2cc(-c3cccs3)nc2s1.
What is the InChIKey of 2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole?
The InChIKey is KKKWUQLBZLCWLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5ClN2S2/c10-8-5-12-4-6(11-9(12)14-8)7-2-1-3-13-7/h1-5H.
What are the key properties of 2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole?
2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole has a molecular weight of 240.74 g/mol, XLogP of 3.78, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 10377022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).