3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine

C10H5Cl2N3S — CID 640853

IUPAC3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine
SMILESClc1ccc2nc(-c3cccs3)c(Cl)n2n1
InChIInChI=1S/C10H5Cl2N3S/c11-7-3-4-8-13-9(6-2-1-5-16-6)10(12)15(8)14-7/h1-5H
InChIKeyNBLLAWZKPXOFGU-UHFFFAOYSA-N
MW270.14 g/mol
LogP3.76
Rot. Bonds1

About 3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine

3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine (PubChem CID 640853) has the molecular formula C10H5Cl2N3S and a molecular weight of 270.14 g/mol. Its IUPAC name is 3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine
PubChem CID640853
Molecular FormulaC10H5Cl2N3S
Molecular Weight270.14 g/mol
Exact Mass268.96
IUPAC Name3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine
SMILESClc1ccc2nc(-c3cccs3)c(Cl)n2n1
InChIInChI=1S/C10H5Cl2N3S/c11-7-3-4-8-13-9(6-2-1-5-16-6)10(12)15(8)14-7/h1-5H
InChIKeyNBLLAWZKPXOFGU-UHFFFAOYSA-N
XLogP3.76
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.14
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine?
The IUPAC name of 3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine (CID 640853) is 3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine?
The canonical SMILES for 3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine is Clc1ccc2nc(-c3cccs3)c(Cl)n2n1.
What is the InChIKey of 3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine?
The InChIKey is NBLLAWZKPXOFGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5Cl2N3S/c11-7-3-4-8-13-9(6-2-1-5-16-6)10(12)15(8)14-7/h1-5H.
What are the key properties of 3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine?
3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine has a molecular weight of 270.14 g/mol, XLogP of 3.76, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dichloro-2-thiophen-2-ylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 640853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).