6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine

C15H8Cl2N4S — CID 46928117

IUPAC6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine
SMILESClc1ccc2nc(-c3ccc(Cl)s3)c(-c3ccncc3)n2n1
InChIInChI=1S/C15H8Cl2N4S/c16-11-2-4-13-19-14(10-1-3-12(17)22-10)15(21(13)20-11)9-5-7-18-8-6-9/h1-8H
InChIKeyGXMOGKCAZRUMDM-UHFFFAOYSA-N
MW347.23 g/mol
LogP4.83
Rot. Bonds2

About 6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine

6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine (PubChem CID 46928117) has the molecular formula C15H8Cl2N4S and a molecular weight of 347.23 g/mol. Its IUPAC name is 6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine
PubChem CID46928117
Molecular FormulaC15H8Cl2N4S
Molecular Weight347.23 g/mol
Exact Mass345.98
IUPAC Name6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine
SMILESClc1ccc2nc(-c3ccc(Cl)s3)c(-c3ccncc3)n2n1
InChIInChI=1S/C15H8Cl2N4S/c16-11-2-4-13-19-14(10-1-3-12(17)22-10)15(21(13)20-11)9-5-7-18-8-6-9/h1-8H
InChIKeyGXMOGKCAZRUMDM-UHFFFAOYSA-N
XLogP4.83
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.23
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
The IUPAC name of 6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine (CID 46928117) is 6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
The canonical SMILES for 6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine is Clc1ccc2nc(-c3ccc(Cl)s3)c(-c3ccncc3)n2n1.
What is the InChIKey of 6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
The InChIKey is GXMOGKCAZRUMDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8Cl2N4S/c16-11-2-4-13-19-14(10-1-3-12(17)22-10)15(21(13)20-11)9-5-7-18-8-6-9/h1-8H.
What are the key properties of 6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine has a molecular weight of 347.23 g/mol, XLogP of 4.83, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(5-chlorothiophen-2-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 46928117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).