6-chloro-3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazine;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-1-(4,6-difluoro-1-methylindazol-5-yl)ethanol;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone;4,6-difluoro-1-methylindazole;3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]-6-(1-ethoxyethenyl)imidazo[1,2-b]pyridazine;1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethanone;[(E)-1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethylideneamino]urea

C105H88Cl3F12N33O5 — CID 172920296

About 6-chloro-3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazine;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-1-(4,6-difluoro-1-methylindazol-5-yl)ethanol;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone;4,6-difluoro-1-methylindazole;3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]-6-(1-ethoxyethenyl)imidazo[1,2-b]pyridazine;1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethanone;[(E)-1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethylideneamino]urea

6-chloro-3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazine;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-1-(4,6-difluoro-1-methylindazol-5-yl)ethanol;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone;4,6-difluoro-1-methylindazole;3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]-6-(1-ethoxyethenyl)imidazo[1,2-b]pyridazine;1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethanone;[(E)-1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethylideneamino]urea (PubChem CID 172920296) has the molecular formula C105H88Cl3F12N33O5 and a molecular weight of 2226.42 g/mol. Its IUPAC name is 6-chloro-3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazine;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-1-(4,6-difluoro-1-methylindazol-5-yl)ethanol;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone;4,6-difluoro-1-methylindazole;3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]-6-(1-ethoxyethenyl)imidazo[1,2-b]pyridazine;1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethanone;[(E)-1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethylideneamino]urea.

Molecular Properties

• Compound Name: 6-chloro-3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazine;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-1-(4,6-difluoro-1-methylindazol-5-yl)ethanol;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone;4,6-difluoro-1-methylindazole;3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]-6-(1-ethoxyethenyl)imidazo[1,2-b]pyridazine;1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethanone;[(E)-1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethylideneamino]urea
• PubChem CID: 172920296
• Molecular Formula: C105H88Cl3F12N33O5
• Molecular Weight: 2226.42 g/mol
• Exact Mass: 2223.65
• IUPAC Name: 6-chloro-3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazine;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-1-(4,6-difluoro-1-methylindazol-5-yl)ethanol;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone;4,6-difluoro-1-methylindazole;3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]-6-(1-ethoxyethenyl)imidazo[1,2-b]pyridazine;1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethanone;[(E)-1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethylideneamino]urea
• SMILES: C/C(=N\NC(N)=O)c1ccc2ncc(C(C)c3c(F)cc4c(cnn4C)c3F)n2n1.C=C(OCC)c1ccc2ncc(C(C)c3c(F)cc4c(cnn4C)c3F)n2n1.CC(=O)c1ccc2ncc(C(C)c3c(F)cc4c(cnn4C)c3F)n2n1.CC(=O)c1cnc2ccc(Cl)nn12.CC(c1c(F)cc2c(cnn2C)c1F)c1cnc2ccc(Cl)nn12.Cn1ncc2c(F)c(C(C)(O)c3cnc4ccc(Cl)nn34)c(F)cc21.Cn1ncc2c(F)cc(F)cc21
• InChI: InChI=1S/C20H19F2N5O.C19H18F2N8O.C18H15F2N5O.C16H12ClF2N5O.C16H12ClF2N5.C8H6ClN3O.C8H6F2N2/c1-5-28-12(3)15-6-7-18-23-10-17(27(18)25-15)11(2)19-14(21)8-16-13(20(19)22)9-24-26(16)4;1-9(17-12(20)6-14-11(18(17)21)7-24-28(14)3)15-8-23-16-5-4-13(27-29(15)16)10(2)25-26-19(22)30;1-9(15-8-21-16-5-4-13(10(2)26)23-25(15)16)17-12(19)6-14-11(18(17)20)7-22-24(14)3;1-16(25,11-7-20-13-4-3-12(17)22-24(11)13)14-9(18)5-10-8(15(14)19)6-21-23(10)2;1-8(12-7-20-14-4-3-13(17)22-24(12)14)15-10(18)5-11-9(16(15)19)6-21-23(11)2;1-5(13)6-4-10-8-3-2-7(9)11-12(6)8;1-12-8-3-5(9)2-7(10)6(8)4-11-12/h6-11H,3,5H2,1-2,4H3;4-9H,1-3H3,(H3,22,26,30);4-9H,1-3H3;3-7,25H,1-2H3;3-8H,1-2H3;2-4H,1H3;2-4H,1H3/b;25-10+
• InChIKey: GXSKGGRJVCATIS-BMEIVVMBSA-N
• XLogP: 19.68
• TPSA: 419.14 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 36
• Rotatable Bonds: 17
• Heavy Atoms: 158
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2226.42
LogP ≤ 5	19.68
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazine;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-1-(4,6-difluoro-1-methylindazol-5-yl)ethanol;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone;4,6-difluoro-1-methylindazole;3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]-6-(1-ethoxyethenyl)imidazo[1,2-b]pyridazine;1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethanone;[(E)-1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethylideneamino]urea?

The IUPAC name of 6-chloro-3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazine;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-1-(4,6-difluoro-1-methylindazol-5-yl)ethanol;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone;4,6-difluoro-1-methylindazole;3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]-6-(1-ethoxyethenyl)imidazo[1,2-b]pyridazine;1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethanone;[(E)-1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethylideneamino]urea (CID 172920296) is 6-chloro-3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazine;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-1-(4,6-difluoro-1-methylindazol-5-yl)ethanol;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone;4,6-difluoro-1-methylindazole;3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]-6-(1-ethoxyethenyl)imidazo[1,2-b]pyridazine;1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethanone;[(E)-1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethylideneamino]urea.

What is the SMILES notation for 6-chloro-3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazine;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-1-(4,6-difluoro-1-methylindazol-5-yl)ethanol;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone;4,6-difluoro-1-methylindazole;3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]-6-(1-ethoxyethenyl)imidazo[1,2-b]pyridazine;1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethanone;[(E)-1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethylideneamino]urea?

The canonical SMILES for 6-chloro-3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazine;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-1-(4,6-difluoro-1-methylindazol-5-yl)ethanol;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone;4,6-difluoro-1-methylindazole;3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]-6-(1-ethoxyethenyl)imidazo[1,2-b]pyridazine;1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethanone;[(E)-1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethylideneamino]urea is C/C(=N\NC(N)=O)c1ccc2ncc(C(C)c3c(F)cc4c(cnn4C)c3F)n2n1.C=C(OCC)c1ccc2ncc(C(C)c3c(F)cc4c(cnn4C)c3F)n2n1.CC(=O)c1ccc2ncc(C(C)c3c(F)cc4c(cnn4C)c3F)n2n1.CC(=O)c1cnc2ccc(Cl)nn12.CC(c1c(F)cc2c(cnn2C)c1F)c1cnc2ccc(Cl)nn12.Cn1ncc2c(F)c(C(C)(O)c3cnc4ccc(Cl)nn34)c(F)cc21.Cn1ncc2c(F)cc(F)cc21.

What is the InChIKey of 6-chloro-3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazine;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-1-(4,6-difluoro-1-methylindazol-5-yl)ethanol;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone;4,6-difluoro-1-methylindazole;3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]-6-(1-ethoxyethenyl)imidazo[1,2-b]pyridazine;1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethanone;[(E)-1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethylideneamino]urea?

The InChIKey is GXSKGGRJVCATIS-BMEIVVMBSA-N. The full InChI is InChI=1S/C20H19F2N5O.C19H18F2N8O.C18H15F2N5O.C16H12ClF2N5O.C16H12ClF2N5.C8H6ClN3O.C8H6F2N2/c1-5-28-12(3)15-6-7-18-23-10-17(27(18)25-15)11(2)19-14(21)8-16-13(20(19)22)9-24-26(16)4;1-9(17-12(20)6-14-11(18(17)21)7-24-28(14)3)15-8-23-16-5-4-13(27-29(15)16)10(2)25-26-19(22)30;1-9(15-8-21-16-5-4-13(10(2)26)23-25(15)16)17-12(19)6-14-11(18(17)20)7-22-24(14)3;1-16(25,11-7-20-13-4-3-12(17)22-24(11)13)14-9(18)5-10-8(15(14)19)6-21-23(10)2;1-8(12-7-20-14-4-3-13(17)22-24(12)14)15-10(18)5-11-9(16(15)19)6-21-23(11)2;1-5(13)6-4-10-8-3-2-7(9)11-12(6)8;1-12-8-3-5(9)2-7(10)6(8)4-11-12/h6-11H,3,5H2,1-2,4H3;4-9H,1-3H3,(H3,22,26,30);4-9H,1-3H3;3-7,25H,1-2H3;3-8H,1-2H3;2-4H,1H3;2-4H,1H3/b;25-10+;;;;;.

What are the key properties of 6-chloro-3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazine;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-1-(4,6-difluoro-1-methylindazol-5-yl)ethanol;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone;4,6-difluoro-1-methylindazole;3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]-6-(1-ethoxyethenyl)imidazo[1,2-b]pyridazine;1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethanone;[(E)-1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethylideneamino]urea?

6-chloro-3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazine;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-1-(4,6-difluoro-1-methylindazol-5-yl)ethanol;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone;4,6-difluoro-1-methylindazole;3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]-6-(1-ethoxyethenyl)imidazo[1,2-b]pyridazine;1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethanone;[(E)-1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethylideneamino]urea has a molecular weight of 2226.42 g/mol, XLogP of 19.68, 17 rotatable bonds, 3 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 6-chloro-3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazine;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)-1-(4,6-difluoro-1-methylindazol-5-yl)ethanol;1-(6-chloroimidazo[1,2-b]pyridazin-3-yl)ethanone;4,6-difluoro-1-methylindazole;3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]-6-(1-ethoxyethenyl)imidazo[1,2-b]pyridazine;1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethanone;[(E)-1-[3-[1-(4,6-difluoro-1-methylindazol-5-yl)ethyl]imidazo[1,2-b]pyridazin-6-yl]ethylideneamino]urea is sourced from PubChem (CID 172920296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).