N-(3,4-dimethylphenyl)-3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine;methane;N-methyl-3-(7-methyl-1-benzothiophen-2-yl)-N-(4-methylcyclohexyl)imidazo[1,2-b]pyridazin-6-amine;4-[methyl-[3-(7-methylthieno[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;4-[(3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-yl)amino]cyclohexan-1-ol

C87H97N19O2S4 — CID 157354008

About N-(3,4-dimethylphenyl)-3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine;methane;N-methyl-3-(7-methyl-1-benzothiophen-2-yl)-N-(4-methylcyclohexyl)imidazo[1,2-b]pyridazin-6-amine;4-[methyl-[3-(7-methylthieno[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;4-[(3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-yl)amino]cyclohexan-1-ol

N-(3,4-dimethylphenyl)-3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine;methane;N-methyl-3-(7-methyl-1-benzothiophen-2-yl)-N-(4-methylcyclohexyl)imidazo[1,2-b]pyridazin-6-amine;4-[methyl-[3-(7-methylthieno[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;4-[(3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-yl)amino]cyclohexan-1-ol (PubChem CID 157354008) has the molecular formula C87H97N19O2S4 and a molecular weight of 1569.13 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine;methane;N-methyl-3-(7-methyl-1-benzothiophen-2-yl)-N-(4-methylcyclohexyl)imidazo[1,2-b]pyridazin-6-amine;4-[methyl-[3-(7-methylthieno[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;4-[(3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-yl)amino]cyclohexan-1-ol.

Molecular Properties

• Compound Name: N-(3,4-dimethylphenyl)-3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine;methane;N-methyl-3-(7-methyl-1-benzothiophen-2-yl)-N-(4-methylcyclohexyl)imidazo[1,2-b]pyridazin-6-amine;4-[methyl-[3-(7-methylthieno[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;4-[(3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-yl)amino]cyclohexan-1-ol
• PubChem CID: 157354008
• Molecular Formula: C87H97N19O2S4
• Molecular Weight: 1569.13 g/mol
• Exact Mass: 1567.70
• IUPAC Name: N-(3,4-dimethylphenyl)-3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine;methane;N-methyl-3-(7-methyl-1-benzothiophen-2-yl)-N-(4-methylcyclohexyl)imidazo[1,2-b]pyridazin-6-amine;4-[methyl-[3-(7-methylthieno[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;4-[(3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-yl)amino]cyclohexan-1-ol
• SMILES: C.C.C.Cc1ccc(Nc2ccc3ncc(-c4cc5ccncc5s4)n3n2)cc1C.Cc1cccc2cc(-c3cnc4ccc(N(C)C5CCC(C)CC5)nn34)sc12.Cc1cncc2cc(-c3cnc4ccc(N(C)C5CCC(O)CC5)nn34)sc12.OC1CCC(Nc2ccc3ncc(-c4cc5ccncc5s4)n3n2)CC1
• InChI: InChI=1S/C23H26N4S.C21H23N5OS.C21H17N5S.C19H19N5OS.3CH4/c1-15-7-9-18(10-8-15)26(3)22-12-11-21-24-14-19(27(21)25-22)20-13-17-6-4-5-16(2)23(17)28-20;1-13-10-22-11-14-9-18(28-21(13)14)17-12-23-19-7-8-20(24-26(17)19)25(2)15-3-5-16(27)6-4-15;1-13-3-4-16(9-14(13)2)24-20-5-6-21-23-11-17(26(21)25-20)18-10-15-7-8-22-12-19(15)27-18;25-14-3-1-13(2-4-14)22-18-5-6-19-21-10-15(24(19)23-18)16-9-12-7-8-20-11-17(12)26-16;;;/h4-6,11-15,18H,7-10H2,1-3H3;7-12,15-16,27H,3-6H2,1-2H3;3-12H,1-2H3,(H,24,25);5-11,13-14,25H,1-4H2,(H,22,23);3*1H4
• InChIKey: BHWDHTCAUCDIKJ-UHFFFAOYSA-N
• XLogP: 20.98
• TPSA: 230.43 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 25
• Rotatable Bonds: 12
• Heavy Atoms: 112
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1569.13
LogP ≤ 5	20.98
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine;methane;N-methyl-3-(7-methyl-1-benzothiophen-2-yl)-N-(4-methylcyclohexyl)imidazo[1,2-b]pyridazin-6-amine;4-[methyl-[3-(7-methylthieno[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;4-[(3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-yl)amino]cyclohexan-1-ol?

The IUPAC name of N-(3,4-dimethylphenyl)-3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine;methane;N-methyl-3-(7-methyl-1-benzothiophen-2-yl)-N-(4-methylcyclohexyl)imidazo[1,2-b]pyridazin-6-amine;4-[methyl-[3-(7-methylthieno[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;4-[(3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-yl)amino]cyclohexan-1-ol (CID 157354008) is N-(3,4-dimethylphenyl)-3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine;methane;N-methyl-3-(7-methyl-1-benzothiophen-2-yl)-N-(4-methylcyclohexyl)imidazo[1,2-b]pyridazin-6-amine;4-[methyl-[3-(7-methylthieno[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;4-[(3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-yl)amino]cyclohexan-1-ol.

What is the SMILES notation for N-(3,4-dimethylphenyl)-3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine;methane;N-methyl-3-(7-methyl-1-benzothiophen-2-yl)-N-(4-methylcyclohexyl)imidazo[1,2-b]pyridazin-6-amine;4-[methyl-[3-(7-methylthieno[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;4-[(3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-yl)amino]cyclohexan-1-ol?

The canonical SMILES for N-(3,4-dimethylphenyl)-3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine;methane;N-methyl-3-(7-methyl-1-benzothiophen-2-yl)-N-(4-methylcyclohexyl)imidazo[1,2-b]pyridazin-6-amine;4-[methyl-[3-(7-methylthieno[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;4-[(3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-yl)amino]cyclohexan-1-ol is C.C.C.Cc1ccc(Nc2ccc3ncc(-c4cc5ccncc5s4)n3n2)cc1C.Cc1cccc2cc(-c3cnc4ccc(N(C)C5CCC(C)CC5)nn34)sc12.Cc1cncc2cc(-c3cnc4ccc(N(C)C5CCC(O)CC5)nn34)sc12.OC1CCC(Nc2ccc3ncc(-c4cc5ccncc5s4)n3n2)CC1.

What is the InChIKey of N-(3,4-dimethylphenyl)-3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine;methane;N-methyl-3-(7-methyl-1-benzothiophen-2-yl)-N-(4-methylcyclohexyl)imidazo[1,2-b]pyridazin-6-amine;4-[methyl-[3-(7-methylthieno[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;4-[(3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-yl)amino]cyclohexan-1-ol?

The InChIKey is BHWDHTCAUCDIKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4S.C21H23N5OS.C21H17N5S.C19H19N5OS.3CH4/c1-15-7-9-18(10-8-15)26(3)22-12-11-21-24-14-19(27(21)25-22)20-13-17-6-4-5-16(2)23(17)28-20;1-13-10-22-11-14-9-18(28-21(13)14)17-12-23-19-7-8-20(24-26(17)19)25(2)15-3-5-16(27)6-4-15;1-13-3-4-16(9-14(13)2)24-20-5-6-21-23-11-17(26(21)25-20)18-10-15-7-8-22-12-19(15)27-18;25-14-3-1-13(2-4-14)22-18-5-6-19-21-10-15(24(19)23-18)16-9-12-7-8-20-11-17(12)26-16;;;/h4-6,11-15,18H,7-10H2,1-3H3;7-12,15-16,27H,3-6H2,1-2H3;3-12H,1-2H3,(H,24,25);5-11,13-14,25H,1-4H2,(H,22,23);3*1H4.

What are the key properties of N-(3,4-dimethylphenyl)-3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine;methane;N-methyl-3-(7-methyl-1-benzothiophen-2-yl)-N-(4-methylcyclohexyl)imidazo[1,2-b]pyridazin-6-amine;4-[methyl-[3-(7-methylthieno[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;4-[(3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-yl)amino]cyclohexan-1-ol?

N-(3,4-dimethylphenyl)-3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine;methane;N-methyl-3-(7-methyl-1-benzothiophen-2-yl)-N-(4-methylcyclohexyl)imidazo[1,2-b]pyridazin-6-amine;4-[methyl-[3-(7-methylthieno[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;4-[(3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-yl)amino]cyclohexan-1-ol has a molecular weight of 1569.13 g/mol, XLogP of 20.98, 12 rotatable bonds, 4 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for N-(3,4-dimethylphenyl)-3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine;methane;N-methyl-3-(7-methyl-1-benzothiophen-2-yl)-N-(4-methylcyclohexyl)imidazo[1,2-b]pyridazin-6-amine;4-[methyl-[3-(7-methylthieno[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;4-[(3-thieno[2,3-c]pyridin-2-ylimidazo[1,2-b]pyridazin-6-yl)amino]cyclohexan-1-ol is sourced from PubChem (CID 157354008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).