5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide

C107H78F12N18O4 — CID 158846194

IUPAC5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide
SMILESC.Cc1ccc(NC(=O)c2cc(-c3ccnn4c(-c5cccc(F)c5F)cnc34)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3ccnn4c(-c5cccc(F)c5F)cnc34)ccc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3ccnn4c(-c5cccc(F)c5F)cnc34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3ccnn4c(-c5cccnc5)cnc34)ccc2C(F)(F)F)cc1
InChIInChI=1S/C27H17F5N4O.C27H20F2N4O.C26H18F3N5O.C26H19F2N5O.CH4/c1-15-5-8-17(9-6-15)35-26(37)20-13-16(7-10-21(20)27(30,31)32)18-11-12-34-36-23(14-33-25(18)36)19-3-2-4-22(28)24(19)29;1-16-6-10-19(11-7-16)32-27(34)22-14-18(9-8-17(22)2)20-12-13-31-33-24(15-30-26(20)33)21-4-3-5-23(28)25(21)29;1-16-4-7-19(8-5-16)33-25(35)21-13-17(6-9-22(21)26(27,28)29)20-10-12-32-34-23(15-31-24(20)34)18-3-2-11-30-14-18;1-15-6-8-18(9-7-15)32-26(34)21-12-17(13-29-16(21)2)19-10-11-31-33-23(14-30-25(19)33)20-4-3-5-22(27)24(20)28;/h2-14H,1H3,(H,35,37);3-15H,1-2H3,(H,32,34);2-15H,1H3,(H,33,35);3-14H,1-2H3,(H,32,34);1H4
InChIKeyIYWFIGKHTLBQLD-UHFFFAOYSA-N
MW1907.90 g/mol
LogP25.41
Rot. Bonds16

About 5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide

5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide (PubChem CID 158846194) has the molecular formula C107H78F12N18O4 and a molecular weight of 1907.90 g/mol. Its IUPAC name is 5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide
PubChem CID158846194
Molecular FormulaC107H78F12N18O4
Molecular Weight1907.90 g/mol
Exact Mass1906.63
IUPAC Name5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide
SMILESC.Cc1ccc(NC(=O)c2cc(-c3ccnn4c(-c5cccc(F)c5F)cnc34)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3ccnn4c(-c5cccc(F)c5F)cnc34)ccc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3ccnn4c(-c5cccc(F)c5F)cnc34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3ccnn4c(-c5cccnc5)cnc34)ccc2C(F)(F)F)cc1
InChIInChI=1S/C27H17F5N4O.C27H20F2N4O.C26H18F3N5O.C26H19F2N5O.CH4/c1-15-5-8-17(9-6-15)35-26(37)20-13-16(7-10-21(20)27(30,31)32)18-11-12-34-36-23(14-33-25(18)36)19-3-2-4-22(28)24(19)29;1-16-6-10-19(11-7-16)32-27(34)22-14-18(9-8-17(22)2)20-12-13-31-33-24(15-30-26(20)33)21-4-3-5-23(28)25(21)29;1-16-4-7-19(8-5-16)33-25(35)21-13-17(6-9-22(21)26(27,28)29)20-10-12-32-34-23(15-31-24(20)34)18-3-2-11-30-14-18;1-15-6-8-18(9-7-15)32-26(34)21-12-17(13-29-16(21)2)19-10-11-31-33-23(14-30-25(19)33)20-4-3-5-22(27)24(20)28;/h2-14H,1H3,(H,35,37);3-15H,1-2H3,(H,32,34);2-15H,1H3,(H,33,35);3-14H,1-2H3,(H,32,34);1H4
InChIKeyIYWFIGKHTLBQLD-UHFFFAOYSA-N
XLogP25.41
TPSA262.94 Ų
H-Bond Donors4
H-Bond Acceptors18
Rotatable Bonds16
Heavy Atoms141
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001907.90
LogP ≤ 525.41
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1018

Analyze 5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide with MolForge

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Related Compounds

TRK degrader CG416
CID 146410659
N-[2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]amino]ethyl]-2-[4-[6-[6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]piperazin-1-yl]acetamide
CID 146410948
2-(2,6-dioxopiperidin-3-yl)-5-[[5-[4-[6-[6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]piperazin-1-yl]-5-oxopentyl]amino]isoindole-1,3-dione
CID 146411074
2-(2,6-dioxopiperidin-3-yl)-5-[3-[4-[6-[6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]piperazine-1-carbonyl]azetidin-1-yl]isoindole-1,3-dione
CID 146410596
2-(2,6-dioxopiperidin-3-yl)-5-[2-[4-[6-[6-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]piperazin-1-yl]ethylamino]isoindole-1,3-dione
CID 149683645
N-[6-[3-(4-fluorophenyl)-1-methyl-5-pyridin-4-ylpyrazol-4-yl]imidazo[1,2-b]pyridazin-2-yl]-3-pyridin-3-ylbenzamide
CID 118537213
6'-Fluoro-N-(6-(4-(4-fluorophenyl)-1,2-dimethyl-1H-imidazol-5-yl)imidazo[1,2-b]pyridazin-2-yl)-[3,3'-bipyridine]-5-carboxamide
CID 118538629
N-(6-(4-(4-Fluorophenyl)-1,2-dimethyl-1H-imidazol-5-yl)imidazo[1,2-b]pyridazin-2-yl)-2,4-dimethyl-5-(pyridin-3-yl)benzamide
CID 118538663
N-(6-(1-(1-(4-cyanobenzoyl)piperidin-4-yl)-4-(4-fluorophenyl)-1H-imidazol-5-yl)imidazo[1,2-b]pyridazin-2-yl)-2-fluoroisonicotinamide
CID 136214278
3-(4-imidazo[1,2-b]pyridazin-3-yltriazol-1-yl)-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide
CID 71449991
N-[4-[[4-[4-[1-[2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]ethyl]triazol-4-yl]butanoyl]piperazin-1-yl]methyl]-3-(trifluoromethyl)phenyl]-3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzamide
CID 156013418
N-[4-[[4-[4-[1-[2-[2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]ethoxy]ethyl]triazol-4-yl]butanoyl]piperazin-1-yl]methyl]-3-(trifluoromethyl)phenyl]-3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzamide
CID 156017680

Frequently Asked Questions

What is the IUPAC name of 5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide?
The IUPAC name of 5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide (CID 158846194) is 5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide.
What is the SMILES notation for 5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide?
The canonical SMILES for 5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide is C.Cc1ccc(NC(=O)c2cc(-c3ccnn4c(-c5cccc(F)c5F)cnc34)ccc2C(F)(F)F)cc1.Cc1ccc(NC(=O)c2cc(-c3ccnn4c(-c5cccc(F)c5F)cnc34)ccc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3ccnn4c(-c5cccc(F)c5F)cnc34)cnc2C)cc1.Cc1ccc(NC(=O)c2cc(-c3ccnn4c(-c5cccnc5)cnc34)ccc2C(F)(F)F)cc1.
What is the InChIKey of 5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide?
The InChIKey is IYWFIGKHTLBQLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H17F5N4O.C27H20F2N4O.C26H18F3N5O.C26H19F2N5O.CH4/c1-15-5-8-17(9-6-15)35-26(37)20-13-16(7-10-21(20)27(30,31)32)18-11-12-34-36-23(14-33-25(18)36)19-3-2-4-22(28)24(19)29;1-16-6-10-19(11-7-16)32-27(34)22-14-18(9-8-17(22)2)20-12-13-31-33-24(15-30-26(20)33)21-4-3-5-23(28)25(21)29;1-16-4-7-19(8-5-16)33-25(35)21-13-17(6-9-22(21)26(27,28)29)20-10-12-32-34-23(15-31-24(20)34)18-3-2-11-30-14-18;1-15-6-8-18(9-7-15)32-26(34)21-12-17(13-29-16(21)2)19-10-11-31-33-23(14-30-25(19)33)20-4-3-5-22(27)24(20)28;/h2-14H,1H3,(H,35,37);3-15H,1-2H3,(H,32,34);2-15H,1H3,(H,33,35);3-14H,1-2H3,(H,32,34);1H4.
What are the key properties of 5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide?
5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide has a molecular weight of 1907.90 g/mol, XLogP of 25.41, 16 rotatable bonds, 4 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-2-methyl-N-(4-methylphenyl)pyridine-3-carboxamide;5-[3-(2,3-difluorophenyl)imidazo[1,2-b]pyridazin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;methane;N-(4-methylphenyl)-5-(3-pyridin-3-ylimidazo[1,2-b]pyridazin-8-yl)-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 158846194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).