4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole

C16H20N6S — CID 91834184

IUPAC4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole
SMILESCc1nc(CCN2CCN(c3ccc4nccn4n3)CC2)cs1
InChIInChI=1S/C16H20N6S/c1-13-18-14(12-23-13)4-6-20-8-10-21(11-9-20)16-3-2-15-17-5-7-22(15)19-16/h2-3,5,7,12H,4,6,8-11H2,1H3
InChIKeyGMVQVSGGULEQRP-UHFFFAOYSA-N
MW328.44 g/mol
LogP1.86
Rot. Bonds4

About 4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole

4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole (PubChem CID 91834184) has the molecular formula C16H20N6S and a molecular weight of 328.44 g/mol. Its IUPAC name is 4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole.

Molecular Properties

Compound Name4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole
PubChem CID91834184
Molecular FormulaC16H20N6S
Molecular Weight328.44 g/mol
Exact Mass328.15
IUPAC Name4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole
SMILESCc1nc(CCN2CCN(c3ccc4nccn4n3)CC2)cs1
InChIInChI=1S/C16H20N6S/c1-13-18-14(12-23-13)4-6-20-8-10-21(11-9-20)16-3-2-15-17-5-7-22(15)19-16/h2-3,5,7,12H,4,6,8-11H2,1H3
InChIKeyGMVQVSGGULEQRP-UHFFFAOYSA-N
XLogP1.86
TPSA49.56 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.44
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole with MolForge

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Related Compounds

4-imidazo[1,2-b]pyridazin-6-yl-N-[(1R)-1-(2-methyl-1,3-thiazol-4-yl)ethyl]piperazine-1-carboxamide
CID 126432065
2-methyl-4-[2-(4-pyrimidin-2-yl-1,4-diazepan-1-yl)ethyl]-1,3-thiazole
CID 91828569
1-[4-[4-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperazin-1-yl]phenyl]ethanone
CID 91835458
4-[4-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperazin-1-yl]thieno[3,2-d]pyrimidine
CID 146124392
2-methyl-4-[[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]methyl]-1,3-thiazole
CID 17450899
6-piperidin-1-ylimidazo[1,2-b]pyridazine
CID 23657730
2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole
CID 82065439
6-[4-[(5-bromothiophen-2-yl)methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine
CID 71850453
2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)-4,6-dimethyl-1,3-benzothiazole
CID 163345219
6-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-b]pyridazine
CID 134310587
6-(4-phenylpiperazin-1-yl)imidazo[1,2-b]pyridazine
CID 134310574
2-methyl-4-[2-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]ethyl]-1,3-thiazole
CID 129059210

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole?
The IUPAC name of 4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole (CID 91834184) is 4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole.
What is the SMILES notation for 4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole?
The canonical SMILES for 4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole is Cc1nc(CCN2CCN(c3ccc4nccn4n3)CC2)cs1.
What is the InChIKey of 4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole?
The InChIKey is GMVQVSGGULEQRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6S/c1-13-18-14(12-23-13)4-6-20-8-10-21(11-9-20)16-3-2-15-17-5-7-22(15)19-16/h2-3,5,7,12H,4,6,8-11H2,1H3.
What are the key properties of 4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole?
4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole has a molecular weight of 328.44 g/mol, XLogP of 1.86, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-imidazo[1,2-b]pyridazin-6-ylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole is sourced from PubChem (CID 91834184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).