3-(1-benzothiophen-2-yl)-8-N-cyclopropyl-6-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine-6,8-diamine;3-(1-benzothiophen-2-yl)-N-(3,4-dichlorophenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-(3-methylphenyl)imidazo[1,2-b]pyridazin-6-amine;3,6-bis(1H-indol-5-yl)imidazo[1,2-b]pyridazine;3-(1H-indol-5-yl)-6-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[1,2-b]pyridazine

C114H92Cl2N24S3 — CID 159603117

About 3-(1-benzothiophen-2-yl)-8-N-cyclopropyl-6-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine-6,8-diamine;3-(1-benzothiophen-2-yl)-N-(3,4-dichlorophenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-(3-methylphenyl)imidazo[1,2-b]pyridazin-6-amine;3,6-bis(1H-indol-5-yl)imidazo[1,2-b]pyridazine;3-(1H-indol-5-yl)-6-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[1,2-b]pyridazine

3-(1-benzothiophen-2-yl)-8-N-cyclopropyl-6-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine-6,8-diamine;3-(1-benzothiophen-2-yl)-N-(3,4-dichlorophenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-(3-methylphenyl)imidazo[1,2-b]pyridazin-6-amine;3,6-bis(1H-indol-5-yl)imidazo[1,2-b]pyridazine;3-(1H-indol-5-yl)-6-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[1,2-b]pyridazine (PubChem CID 159603117) has the molecular formula C114H92Cl2N24S3 and a molecular weight of 1965.26 g/mol. Its IUPAC name is 3-(1-benzothiophen-2-yl)-8-N-cyclopropyl-6-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine-6,8-diamine;3-(1-benzothiophen-2-yl)-N-(3,4-dichlorophenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-(3-methylphenyl)imidazo[1,2-b]pyridazin-6-amine;3,6-bis(1H-indol-5-yl)imidazo[1,2-b]pyridazine;3-(1H-indol-5-yl)-6-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[1,2-b]pyridazine.

Molecular Properties

• Compound Name: 3-(1-benzothiophen-2-yl)-8-N-cyclopropyl-6-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine-6,8-diamine;3-(1-benzothiophen-2-yl)-N-(3,4-dichlorophenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-(3-methylphenyl)imidazo[1,2-b]pyridazin-6-amine;3,6-bis(1H-indol-5-yl)imidazo[1,2-b]pyridazine;3-(1H-indol-5-yl)-6-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[1,2-b]pyridazine
• PubChem CID: 159603117
• Molecular Formula: C114H92Cl2N24S3
• Molecular Weight: 1965.26 g/mol
• Exact Mass: 1962.65
• IUPAC Name: 3-(1-benzothiophen-2-yl)-8-N-cyclopropyl-6-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine-6,8-diamine;3-(1-benzothiophen-2-yl)-N-(3,4-dichlorophenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-(3-methylphenyl)imidazo[1,2-b]pyridazin-6-amine;3,6-bis(1H-indol-5-yl)imidazo[1,2-b]pyridazine;3-(1H-indol-5-yl)-6-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[1,2-b]pyridazine
• SMILES: CN1CCN(Cc2ccc(-c3ccc4ncc(-c5ccc6[nH]ccc6c5)n4n3)cc2)CC1.Cc1ccc(Nc2cc(NC3CC3)c3ncc(-c4cc5ccccc5s4)n3n2)cc1C.Cc1cccc(Nc2ccc3ncc(-c4cc5ccccc5s4)n3n2)c1.Clc1ccc(Nc2ccc3ncc(-c4cc5ccccc5s4)n3n2)cc1Cl.c1cc2cc(-c3ccc4ncc(-c5ccc6[nH]ccc6c5)n4n3)ccc2[nH]1
• InChI: InChI=1S/C26H26N6.C25H23N5S.C22H15N5.C21H16N4S.C20H12Cl2N4S/c1-30-12-14-31(15-13-30)18-19-2-4-20(5-3-19)24-8-9-26-28-17-25(32(26)29-24)22-6-7-23-21(16-22)10-11-27-23;1-15-7-8-19(11-16(15)2)28-24-13-20(27-18-9-10-18)25-26-14-21(30(25)29-24)23-12-17-5-3-4-6-22(17)31-23;1-3-18-15(7-9-23-18)11-14(1)20-5-6-22-25-13-21(27(22)26-20)17-2-4-19-16(12-17)8-10-24-19;1-14-5-4-7-16(11-14)23-20-9-10-21-22-13-17(25(21)24-20)19-12-15-6-2-3-8-18(15)26-19;21-14-6-5-13(10-15(14)22)24-19-7-8-20-23-11-16(26(20)25-19)18-9-12-3-1-2-4-17(12)27-18/h2-11,16-17,27H,12-15,18H2,1H3;3-8,11-14,18,27H,9-10H2,1-2H3,(H,28,29);1-13,23-24H;2-13H,1H3,(H,23,24);1-11H,(H,24,25)
• InChIKey: MLSVIQKMQGFCOZ-UHFFFAOYSA-N
• XLogP: 28.19
• TPSA: 252.92 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 24
• Rotatable Bonds: 17
• Heavy Atoms: 143
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1965.26
LogP ≤ 5	28.19
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'het_6_tetrazine(18)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-(1-benzothiophen-2-yl)-8-N-cyclopropyl-6-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine-6,8-diamine;3-(1-benzothiophen-2-yl)-N-(3,4-dichlorophenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-(3-methylphenyl)imidazo[1,2-b]pyridazin-6-amine;3,6-bis(1H-indol-5-yl)imidazo[1,2-b]pyridazine;3-(1H-indol-5-yl)-6-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[1,2-b]pyridazine?

The IUPAC name of 3-(1-benzothiophen-2-yl)-8-N-cyclopropyl-6-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine-6,8-diamine;3-(1-benzothiophen-2-yl)-N-(3,4-dichlorophenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-(3-methylphenyl)imidazo[1,2-b]pyridazin-6-amine;3,6-bis(1H-indol-5-yl)imidazo[1,2-b]pyridazine;3-(1H-indol-5-yl)-6-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[1,2-b]pyridazine (CID 159603117) is 3-(1-benzothiophen-2-yl)-8-N-cyclopropyl-6-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine-6,8-diamine;3-(1-benzothiophen-2-yl)-N-(3,4-dichlorophenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-(3-methylphenyl)imidazo[1,2-b]pyridazin-6-amine;3,6-bis(1H-indol-5-yl)imidazo[1,2-b]pyridazine;3-(1H-indol-5-yl)-6-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[1,2-b]pyridazine.

What is the SMILES notation for 3-(1-benzothiophen-2-yl)-8-N-cyclopropyl-6-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine-6,8-diamine;3-(1-benzothiophen-2-yl)-N-(3,4-dichlorophenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-(3-methylphenyl)imidazo[1,2-b]pyridazin-6-amine;3,6-bis(1H-indol-5-yl)imidazo[1,2-b]pyridazine;3-(1H-indol-5-yl)-6-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[1,2-b]pyridazine?

The canonical SMILES for 3-(1-benzothiophen-2-yl)-8-N-cyclopropyl-6-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine-6,8-diamine;3-(1-benzothiophen-2-yl)-N-(3,4-dichlorophenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-(3-methylphenyl)imidazo[1,2-b]pyridazin-6-amine;3,6-bis(1H-indol-5-yl)imidazo[1,2-b]pyridazine;3-(1H-indol-5-yl)-6-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[1,2-b]pyridazine is CN1CCN(Cc2ccc(-c3ccc4ncc(-c5ccc6[nH]ccc6c5)n4n3)cc2)CC1.Cc1ccc(Nc2cc(NC3CC3)c3ncc(-c4cc5ccccc5s4)n3n2)cc1C.Cc1cccc(Nc2ccc3ncc(-c4cc5ccccc5s4)n3n2)c1.Clc1ccc(Nc2ccc3ncc(-c4cc5ccccc5s4)n3n2)cc1Cl.c1cc2cc(-c3ccc4ncc(-c5ccc6[nH]ccc6c5)n4n3)ccc2[nH]1.

What is the InChIKey of 3-(1-benzothiophen-2-yl)-8-N-cyclopropyl-6-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine-6,8-diamine;3-(1-benzothiophen-2-yl)-N-(3,4-dichlorophenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-(3-methylphenyl)imidazo[1,2-b]pyridazin-6-amine;3,6-bis(1H-indol-5-yl)imidazo[1,2-b]pyridazine;3-(1H-indol-5-yl)-6-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[1,2-b]pyridazine?

The InChIKey is MLSVIQKMQGFCOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N6.C25H23N5S.C22H15N5.C21H16N4S.C20H12Cl2N4S/c1-30-12-14-31(15-13-30)18-19-2-4-20(5-3-19)24-8-9-26-28-17-25(32(26)29-24)22-6-7-23-21(16-22)10-11-27-23;1-15-7-8-19(11-16(15)2)28-24-13-20(27-18-9-10-18)25-26-14-21(30(25)29-24)23-12-17-5-3-4-6-22(17)31-23;1-3-18-15(7-9-23-18)11-14(1)20-5-6-22-25-13-21(27(22)26-20)17-2-4-19-16(12-17)8-10-24-19;1-14-5-4-7-16(11-14)23-20-9-10-21-22-13-17(25(21)24-20)19-12-15-6-2-3-8-18(15)26-19;21-14-6-5-13(10-15(14)22)24-19-7-8-20-23-11-16(26(20)25-19)18-9-12-3-1-2-4-17(12)27-18/h2-11,16-17,27H,12-15,18H2,1H3;3-8,11-14,18,27H,9-10H2,1-2H3,(H,28,29);1-13,23-24H;2-13H,1H3,(H,23,24);1-11H,(H,24,25).

What are the key properties of 3-(1-benzothiophen-2-yl)-8-N-cyclopropyl-6-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine-6,8-diamine;3-(1-benzothiophen-2-yl)-N-(3,4-dichlorophenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-(3-methylphenyl)imidazo[1,2-b]pyridazin-6-amine;3,6-bis(1H-indol-5-yl)imidazo[1,2-b]pyridazine;3-(1H-indol-5-yl)-6-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[1,2-b]pyridazine?

3-(1-benzothiophen-2-yl)-8-N-cyclopropyl-6-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine-6,8-diamine;3-(1-benzothiophen-2-yl)-N-(3,4-dichlorophenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-(3-methylphenyl)imidazo[1,2-b]pyridazin-6-amine;3,6-bis(1H-indol-5-yl)imidazo[1,2-b]pyridazine;3-(1H-indol-5-yl)-6-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[1,2-b]pyridazine has a molecular weight of 1965.26 g/mol, XLogP of 28.19, 17 rotatable bonds, 7 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(1-benzothiophen-2-yl)-8-N-cyclopropyl-6-N-(3,4-dimethylphenyl)imidazo[1,2-b]pyridazine-6,8-diamine;3-(1-benzothiophen-2-yl)-N-(3,4-dichlorophenyl)imidazo[1,2-b]pyridazin-6-amine;3-(1-benzothiophen-2-yl)-N-(3-methylphenyl)imidazo[1,2-b]pyridazin-6-amine;3,6-bis(1H-indol-5-yl)imidazo[1,2-b]pyridazine;3-(1H-indol-5-yl)-6-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]imidazo[1,2-b]pyridazine is sourced from PubChem (CID 159603117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).