[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methanone;[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(1H-pyrazol-5-yl)methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(4H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone

C106H115F7N26O9 — CID 158098708

About [4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methanone;[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(1H-pyrazol-5-yl)methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(4H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone

[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methanone;[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(1H-pyrazol-5-yl)methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(4H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone (PubChem CID 158098708) has the molecular formula C106H115F7N26O9 and a molecular weight of 2030.24 g/mol. Its IUPAC name is [4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methanone;[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(1H-pyrazol-5-yl)methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(4H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone.

Molecular Properties

• Compound Name: [4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methanone;[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(1H-pyrazol-5-yl)methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(4H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone
• PubChem CID: 158098708
• Molecular Formula: C106H115F7N26O9
• Molecular Weight: 2030.24 g/mol
• Exact Mass: 2028.92
• IUPAC Name: [4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methanone;[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(1H-pyrazol-5-yl)methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(4H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone
• SMILES: CC(C)c1cc(-c2ccc(F)cc2)nn2cc(C(=O)N3CCN(C(=O)C4=NCC=N4)CC3(C)C)nc12.CC(C)c1cc(-c2ccc(F)cc2)nn2cc(C(=O)N3CCN(C(=O)C4CC(O)(C(F)(F)F)C4)CC3(C)C)nc12.CC(C)c1cc(-c2ccc(F)cc2)nn2cc(C(=O)N3CCN(C(=O)c4ccn[nH]4)CC3(C)C)nc12.CC(C)c1cc(-c2ccc(F)cc2)nn2cc(C(=O)N3CCN(C(=O)c4ncc[nH]4)CC3(C)C)nc12
• InChI: InChI=1S/C28H31F4N5O3.3C26H28FN7O2/c1-16(2)20-11-21(17-5-7-19(29)8-6-17)34-37-14-22(33-23(20)37)25(39)36-10-9-35(15-26(36,3)4)24(38)18-12-27(40,13-18)28(30,31)32;2*1-16(2)19-13-20(17-5-7-18(27)8-6-17)31-34-14-21(30-23(19)34)24(35)33-12-11-32(15-26(33,3)4)25(36)22-28-9-10-29-22;1-16(2)19-13-21(17-5-7-18(27)8-6-17)31-34-14-22(29-23(19)34)25(36)33-12-11-32(15-26(33,3)4)24(35)20-9-10-28-30-20/h5-8,11,14,16,18,40H,9-10,12-13,15H2,1-4H3;5-9,13-14,16H,10-12,15H2,1-4H3;5-10,13-14,16H,11-12,15H2,1-4H3,(H,28,29);5-10,13-14,16H,11-12,15H2,1-4H3,(H,28,30)
• InChIKey: FOZHCBSNZBASLF-UHFFFAOYSA-N
• XLogP: 15.15
• TPSA: 385.55 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 25
• Rotatable Bonds: 16
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2030.24
LogP ≤ 5	15.15
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of [4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methanone;[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(1H-pyrazol-5-yl)methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(4H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone?

The IUPAC name of [4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methanone;[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(1H-pyrazol-5-yl)methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(4H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone (CID 158098708) is [4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methanone;[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(1H-pyrazol-5-yl)methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(4H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone.

What is the SMILES notation for [4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methanone;[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(1H-pyrazol-5-yl)methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(4H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone?

The canonical SMILES for [4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methanone;[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(1H-pyrazol-5-yl)methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(4H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone is CC(C)c1cc(-c2ccc(F)cc2)nn2cc(C(=O)N3CCN(C(=O)C4=NCC=N4)CC3(C)C)nc12.CC(C)c1cc(-c2ccc(F)cc2)nn2cc(C(=O)N3CCN(C(=O)C4CC(O)(C(F)(F)F)C4)CC3(C)C)nc12.CC(C)c1cc(-c2ccc(F)cc2)nn2cc(C(=O)N3CCN(C(=O)c4ccn[nH]4)CC3(C)C)nc12.CC(C)c1cc(-c2ccc(F)cc2)nn2cc(C(=O)N3CCN(C(=O)c4ncc[nH]4)CC3(C)C)nc12.

What is the InChIKey of [4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methanone;[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(1H-pyrazol-5-yl)methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(4H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone?

The InChIKey is FOZHCBSNZBASLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H31F4N5O3.3C26H28FN7O2/c1-16(2)20-11-21(17-5-7-19(29)8-6-17)34-37-14-22(33-23(20)37)25(39)36-10-9-35(15-26(36,3)4)24(38)18-12-27(40,13-18)28(30,31)32;2*1-16(2)19-13-20(17-5-7-18(27)8-6-17)31-34-14-21(30-23(19)34)24(35)33-12-11-32(15-26(33,3)4)25(36)22-28-9-10-29-22;1-16(2)19-13-21(17-5-7-18(27)8-6-17)31-34-14-22(29-23(19)34)25(36)33-12-11-32(15-26(33,3)4)24(35)20-9-10-28-30-20/h5-8,11,14,16,18,40H,9-10,12-13,15H2,1-4H3;5-9,13-14,16H,10-12,15H2,1-4H3;5-10,13-14,16H,11-12,15H2,1-4H3,(H,28,29);5-10,13-14,16H,11-12,15H2,1-4H3,(H,28,30).

What are the key properties of [4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methanone;[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(1H-pyrazol-5-yl)methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(4H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone?

[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methanone;[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(1H-pyrazol-5-yl)methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(4H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone has a molecular weight of 2030.24 g/mol, XLogP of 15.15, 16 rotatable bonds, 3 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for [4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]methanone;[4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-1-yl]-(1H-pyrazol-5-yl)methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(1H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone;[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazin-2-yl]-[4-(4H-imidazole-2-carbonyl)-2,2-dimethylpiperazin-1-yl]methanone is sourced from PubChem (CID 158098708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).