3,6-dichloro-2-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine

C10H4Cl3N3S — CID 640852

IUPAC3,6-dichloro-2-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine
SMILESClc1ccc2nc(-c3ccc(Cl)s3)c(Cl)n2n1
InChIInChI=1S/C10H4Cl3N3S/c11-6-2-4-8-14-9(10(13)16(8)15-6)5-1-3-7(12)17-5/h1-4H
InChIKeyBKFQPHFPGRTGPB-UHFFFAOYSA-N
MW304.59 g/mol
LogP4.42
Rot. Bonds1

About 3,6-dichloro-2-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine

3,6-dichloro-2-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine (PubChem CID 640852) has the molecular formula C10H4Cl3N3S and a molecular weight of 304.59 g/mol. Its IUPAC name is 3,6-dichloro-2-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name3,6-dichloro-2-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine
PubChem CID640852
Molecular FormulaC10H4Cl3N3S
Molecular Weight304.59 g/mol
Exact Mass302.92
IUPAC Name3,6-dichloro-2-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine
SMILESClc1ccc2nc(-c3ccc(Cl)s3)c(Cl)n2n1
InChIInChI=1S/C10H4Cl3N3S/c11-6-2-4-8-14-9(10(13)16(8)15-6)5-1-3-7(12)17-5/h1-4H
InChIKeyBKFQPHFPGRTGPB-UHFFFAOYSA-N
XLogP4.42
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.59
LogP ≤ 54.42
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-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine?
The IUPAC name of 3,6-dichloro-2-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine (CID 640852) is 3,6-dichloro-2-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 3,6-dichloro-2-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 3,6-dichloro-2-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine is Clc1ccc2nc(-c3ccc(Cl)s3)c(Cl)n2n1.
What is the InChIKey of 3,6-dichloro-2-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine?
The InChIKey is BKFQPHFPGRTGPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H4Cl3N3S/c11-6-2-4-8-14-9(10(13)16(8)15-6)5-1-3-7(12)17-5/h1-4H.
What are the key properties of 3,6-dichloro-2-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine?
3,6-dichloro-2-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine has a molecular weight of 304.59 g/mol, XLogP of 4.42, 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-(5-chlorothiophen-2-yl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 640852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).