3-(1-benzothiophen-2-yl)-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(5-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(6-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(7-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine

C116H105N25S2 — CID 158050621

About 3-(1-benzothiophen-2-yl)-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(5-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(6-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(7-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine

3-(1-benzothiophen-2-yl)-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(5-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(6-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(7-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine (PubChem CID 158050621) has the molecular formula C116H105N25S2 and a molecular weight of 1913.42 g/mol. Its IUPAC name is 3-(1-benzothiophen-2-yl)-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(5-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(6-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(7-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine.

Molecular Properties

• Compound Name: 3-(1-benzothiophen-2-yl)-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(5-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(6-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(7-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine
• PubChem CID: 158050621
• Molecular Formula: C116H105N25S2
• Molecular Weight: 1913.42 g/mol
• Exact Mass: 1911.84
• IUPAC Name: 3-(1-benzothiophen-2-yl)-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(5-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(6-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(7-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine
• SMILES: CN1CCN(c2cccc(Nc3ccc4ncc(-c5cc6ccccc6s5)n4n3)c2)CC1.Cc1ccc(Nc2ccc3ncc(-c4cc5cccc(C)c5[nH]4)n3n2)cc1C.Cc1ccc(Nc2ccc3ncc(-c4cc5ccccc5s4)n3n2)cc1C.Cc1ccc2[nH]c(-c3cnc4ccc(Nc5ccc(C)c(C)c5)nn34)cc2c1.Cc1ccc2cc(-c3cnc4ccc(Nc5ccc(C)c(C)c5)nn34)[nH]c2c1
• InChI: InChI=1S/C25H24N6S.3C23H21N5.C22H18N4S/c1-29-11-13-30(14-12-29)20-7-4-6-19(16-20)27-24-9-10-25-26-17-21(31(25)28-24)23-15-18-5-2-3-8-22(18)32-23;1-14-4-7-19-17(10-14)12-20(26-19)21-13-24-23-9-8-22(27-28(21)23)25-18-6-5-15(2)16(3)11-18;1-14-4-6-17-12-20(26-19(17)10-14)21-13-24-23-9-8-22(27-28(21)23)25-18-7-5-15(2)16(3)11-18;1-14-7-8-18(11-16(14)3)25-21-9-10-22-24-13-20(28(22)27-21)19-12-17-6-4-5-15(2)23(17)26-19;1-14-7-8-17(11-15(14)2)24-21-9-10-22-23-13-18(26(22)25-21)20-12-16-5-3-4-6-19(16)27-20/h2-10,15-17H,11-14H2,1H3,(H,27,28);3*4-13,26H,1-3H3,(H,25,27);3-13H,1-2H3,(H,24,25)
• InChIKey: FJKYLWBAXNWAJL-UHFFFAOYSA-N
• XLogP: 27.72
• TPSA: 264.95 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 24
• Rotatable Bonds: 16
• Heavy Atoms: 143
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1913.42
LogP ≤ 5	27.72
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 3-(1-benzothiophen-2-yl)-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(5-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(6-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(7-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine?

The IUPAC name of 3-(1-benzothiophen-2-yl)-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(5-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(6-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(7-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine (CID 158050621) is 3-(1-benzothiophen-2-yl)-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(5-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(6-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(7-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine.

What is the SMILES notation for 3-(1-benzothiophen-2-yl)-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(5-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(6-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(7-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine?

The canonical SMILES for 3-(1-benzothiophen-2-yl)-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(5-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(6-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(7-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine is CN1CCN(c2cccc(Nc3ccc4ncc(-c5cc6ccccc6s5)n4n3)c2)CC1.Cc1ccc(Nc2ccc3ncc(-c4cc5cccc(C)c5[nH]4)n3n2)cc1C.Cc1ccc(Nc2ccc3ncc(-c4cc5ccccc5s4)n3n2)cc1C.Cc1ccc2[nH]c(-c3cnc4ccc(Nc5ccc(C)c(C)c5)nn34)cc2c1.Cc1ccc2cc(-c3cnc4ccc(Nc5ccc(C)c(C)c5)nn34)[nH]c2c1.

What is the InChIKey of 3-(1-benzothiophen-2-yl)-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(5-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(6-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(7-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine?

The InChIKey is FJKYLWBAXNWAJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N6S.3C23H21N5.C22H18N4S/c1-29-11-13-30(14-12-29)20-7-4-6-19(16-20)27-24-9-10-25-26-17-21(31(25)28-24)23-15-18-5-2-3-8-22(18)32-23;1-14-4-7-19-17(10-14)12-20(26-19)21-13-24-23-9-8-22(27-28(21)23)25-18-6-5-15(2)16(3)11-18;1-14-4-6-17-12-20(26-19(17)10-14)21-13-24-23-9-8-22(27-28(21)23)25-18-7-5-15(2)16(3)11-18;1-14-7-8-18(11-16(14)3)25-21-9-10-22-24-13-20(28(22)27-21)19-12-17-6-4-5-15(2)23(17)26-19;1-14-7-8-17(11-15(14)2)24-21-9-10-22-23-13-18(26(22)25-21)20-12-16-5-3-4-6-19(16)27-20/h2-10,15-17H,11-14H2,1H3,(H,27,28);3*4-13,26H,1-3H3,(H,25,27);3-13H,1-2H3,(H,24,25).

What are the key properties of 3-(1-benzothiophen-2-yl)-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(5-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(6-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(7-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine?

3-(1-benzothiophen-2-yl)-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(5-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(6-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(7-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine has a molecular weight of 1913.42 g/mol, XLogP of 27.72, 16 rotatable bonds, 8 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(1-benzothiophen-2-yl)-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(5-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(6-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine;N-(3,4-dimethylphenyl)-3-(7-methyl-1H-indol-2-yl)imidazo[1,2-b]pyridazin-6-amine is sourced from PubChem (CID 158050621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).