5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole

C14H15ClN6S — CID 89494418

IUPAC5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole
SMILESCN1CCN(c2ncc(-c3cnc4ccc(Cl)nn34)s2)CC1
InChIInChI=1S/C14H15ClN6S/c1-19-4-6-20(7-5-19)14-17-9-11(22-14)10-8-16-13-3-2-12(15)18-21(10)13/h2-3,8-9H,4-7H2,1H3
InChIKeyLEWXDCDSKJPKIM-UHFFFAOYSA-N
MW334.84 g/mol
LogP2.26
Rot. Bonds2

About 5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole

5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole (PubChem CID 89494418) has the molecular formula C14H15ClN6S and a molecular weight of 334.84 g/mol. Its IUPAC name is 5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole.

Molecular Properties

Compound Name5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole
PubChem CID89494418
Molecular FormulaC14H15ClN6S
Molecular Weight334.84 g/mol
Exact Mass334.08
IUPAC Name5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole
SMILESCN1CCN(c2ncc(-c3cnc4ccc(Cl)nn34)s2)CC1
InChIInChI=1S/C14H15ClN6S/c1-19-4-6-20(7-5-19)14-17-9-11(22-14)10-8-16-13-3-2-12(15)18-21(10)13/h2-3,8-9H,4-7H2,1H3
InChIKeyLEWXDCDSKJPKIM-UHFFFAOYSA-N
XLogP2.26
TPSA49.56 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.84
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole with MolForge

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Related Compounds

2-Methyl-5-[[3-methyl-4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperazin-1-yl]methyl]-1,3-thiazole
CID 53568125
2-[4-(Tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]-1,3-thiazole
CID 24590333
4-Fluoro-8-(4-methylpiperazin-1-yl)-5-thia-1,7,10,12-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaene
CID 140568493
2-(6-Chloroimidazo[1,2-b]pyridazin-3-yl)-5-(trifluoromethyl)-1,3-thiazole
CID 168873698
2-(6-Chloroimidazo[1,2-b]pyridazin-3-yl)-4-(trifluoromethyl)-1,3-thiazole
CID 168873733
2-[4-([1,2,4]Triazolo[4,3-b]pyridazin-6-yl)piperazin-1-yl]-5-(trifluoromethyl)-1,3-thiazole
CID 133508734
2-[4-(3-Methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperazin-1-yl]-5-(trifluoromethyl)-1,3-thiazole
CID 133508735
1-{2-Methylimidazo[1,2-b]pyridazin-6-yl}-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]piperazine
CID 155974842
Imidazo[1,2-b]pyridazine,6-chloro-3-ethyl-2-[[2-(2-thiazolyl)-1h-imidazol-1-yl]methyl]-
CID 22335067
6-Chloro-3-methyl-2-[(2-pyrimidin-2-ylimidazol-1-yl)methyl]imidazo[1,2-b]pyridazine
CID 22335088
8-(4-Methyl-1-piperazinyl)-5-(5-thiazolyl)-1,2,4-triazolo[4,3-a]pyrazine
CID 53391184
6-Chloro-3-(2-methylsulfanylpyrimidin-5-yl)imidazo[1,2-b]pyridazine
CID 57478201

Frequently Asked Questions

What is the IUPAC name of 5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole?
The IUPAC name of 5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole (CID 89494418) is 5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole.
What is the SMILES notation for 5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole?
The canonical SMILES for 5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole is CN1CCN(c2ncc(-c3cnc4ccc(Cl)nn34)s2)CC1.
What is the InChIKey of 5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole?
The InChIKey is LEWXDCDSKJPKIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN6S/c1-19-4-6-20(7-5-19)14-17-9-11(22-14)10-8-16-13-3-2-12(15)18-21(10)13/h2-3,8-9H,4-7H2,1H3.
What are the key properties of 5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole?
5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole has a molecular weight of 334.84 g/mol, XLogP of 2.26, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole is sourced from PubChem (CID 89494418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).