2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone

C70H62BrN11O3 — CID 143046911

IUPAC2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone
SMILESCCn1nc(C)c(Br)c1C(=O)Cc1c(-c2ccc(CCc3ccc4nc(-c5ccc(C)cc5)c(CC(=O)c5cc6ccccc6n5C)n4c3)cc2)nc2ccc(CCc3ccc(-c4nc5ccc(C)cn5c4CC(=O)c4nccn4C)cc3)cn12
InChIInChI=1S/C70H62BrN11O3/c1-7-82-69(65(71)45(4)76-82)60(84)38-57-67(75-64-33-24-49(42-81(57)64)18-16-47-21-29-52(30-22-47)68-58(39-61(85)70-72-34-35-77(70)5)79-40-44(3)14-31-62(79)73-68)51-27-19-46(20-28-51)15-17-48-23-32-63-74-66(50-25-12-43(2)13-26-50)56(80(63)41-48)37-59(83)55-36-53-10-8-9-11-54(53)78(55)6/h8-14,19-36,40-42H,7,15-18,37-39H2,1-6H3
InChIKeyHDWJDXQKMDBULU-UHFFFAOYSA-N
MW1185.24 g/mol
LogP13.61
Rot. Bonds19

About 2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone

2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone (PubChem CID 143046911) has the molecular formula C70H62BrN11O3 and a molecular weight of 1185.24 g/mol. Its IUPAC name is 2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone.

Molecular Properties

Compound Name2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone
PubChem CID143046911
Molecular FormulaC70H62BrN11O3
Molecular Weight1185.24 g/mol
Exact Mass1183.42
IUPAC Name2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone
SMILESCCn1nc(C)c(Br)c1C(=O)Cc1c(-c2ccc(CCc3ccc4nc(-c5ccc(C)cc5)c(CC(=O)c5cc6ccccc6n5C)n4c3)cc2)nc2ccc(CCc3ccc(-c4nc5ccc(C)cn5c4CC(=O)c4nccn4C)cc3)cn12
InChIInChI=1S/C70H62BrN11O3/c1-7-82-69(65(71)45(4)76-82)60(84)38-57-67(75-64-33-24-49(42-81(57)64)18-16-47-21-29-52(30-22-47)68-58(39-61(85)70-72-34-35-77(70)5)79-40-44(3)14-31-62(79)73-68)51-27-19-46(20-28-51)15-17-48-23-32-63-74-66(50-25-12-43(2)13-26-50)56(80(63)41-48)37-59(83)55-36-53-10-8-9-11-54(53)78(55)6/h8-14,19-36,40-42H,7,15-18,37-39H2,1-6H3
InChIKeyHDWJDXQKMDBULU-UHFFFAOYSA-N
XLogP13.61
TPSA143.68 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds19
Heavy Atoms85
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001185.24
LogP ≤ 513.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[1-(2,2-Dimethylpropyl)-6-fluoro-5-(2-methylpyrimidin-5-yl)indazol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-2-fluoro-5-(2-methylpyrimidin-5-yl)indol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-6-fluoro-5-(2-methylpyrimidin-5-yl)indol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-2-methyl-5-(2-methylpyrimidin-5-yl)indol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-5-(2-methylpyrimidin-5-yl)pyrazolo[3,4-c]pyridin-3-yl]-2,2,2-trifluoroethanone
CID 157553292
1-[1-(2,2-Dimethylpropyl)-7-methyl-5-(2-methylpyrimidin-5-yl)indazol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-7-methyl-5-(2-methylpyrimidin-5-yl)pyrrolo[2,3-c]pyridin-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-5-(2-methylpyrimidin-5-yl)indazol-3-yl]-2,2,2-trifluoroethanone;1-[1-(2,2-dimethylpropyl)-5-(2-methylpyrimidin-5-yl)indol-3-yl]-2,2,2-trifluoroethanone;1-[1-(2,2-dimethylpropyl)-5-(2-methylpyrimidin-5-yl)pyrrolo[2,3-c]pyridin-3-yl]-2,2,2-trifluoroethanone
CID 157925707
1-[1-(2,2-Dimethylpropyl)-6-fluoro-5-(2-methylpyrimidin-5-yl)indazol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-2-fluoro-5-(2-methylpyrimidin-5-yl)indol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-6-fluoro-5-(2-methylpyrimidin-5-yl)indol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-2-methyl-5-(2-methylpyrimidin-5-yl)indol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-5-(2-methylpyrimidin-5-yl)indazol-3-yl]-2,2,2-trifluoroethanone;1-[1-(2,2-dimethylpropyl)-5-(2-methylpyrimidin-5-yl)pyrazolo[3,4-c]pyridin-3-yl]-2,2,2-trifluoroethanone
CID 157971119
6-[(2,6-difluoro-4-imidazo[1,2-a]pyridin-6-ylphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;6-[[2,6-difluoro-4-(2-methylindazol-4-yl)phenyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;6-[[3-fluoro-5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;2-[[2-fluoro-4-[5-(trifluoromethyl)-2H-pyrrol-4-yl]phenyl]methyl]-3H-isoindol-1-one;2-[[6-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]-3H-isoindol-1-one
CID 159110891
1-[3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylphenyl]-2-[3-pyrimidin-5-yl-5-(trifluoromethyl)phenyl]ethanone;1-[3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylphenyl]-2-[3-[4-(pyrrolidin-1-ylmethyl)imidazol-1-yl]-5-(trifluoromethyl)phenyl]ethanone;1-[3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylphenyl]-2-[4-(trifluoromethyl)phenyl]ethanone;3-[2-[2-methyl-5-[6-(trifluoromethyl)-3H-indol-2-yl]phenyl]ethynyl]imidazo[1,2-b]pyridazine
CID 159500342
methane;(4-methylpiperazin-1-yl)-(2-propan-2-yl-3H-indol-5-yl)methanone;1-methyl-2-propan-2-ylbenzimidazole;2-methyl-1-propan-2-ylindole;5-methyl-2-propan-2-yl-3H-indole;1-propan-2-ylimidazole;1-propan-2-ylindole;1-(2-propan-2-yl-3H-indol-5-yl)ethanone;1-propan-2-ylpyrazole;2-propan-2-yl-3H-pyrrolo[3,2-b]pyridine;2-propan-2-yl-6-(trifluoromethyl)-3H-indole
CID 159645131
1-[1-(2,2-Dimethylpropyl)-7-methyl-5-(2-methylpyrimidin-5-yl)indazol-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-7-methyl-5-(2-methylpyrimidin-5-yl)pyrazolo[3,4-c]pyridin-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-7-methyl-5-(2-methylpyrimidin-5-yl)pyrrolo[2,3-c]pyridin-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-5-(2-methylpyrimidin-5-yl)indol-3-yl]-2,2,2-trifluoroethanone;1-[1-(2,2-dimethylpropyl)-5-(2-methylpyrimidin-5-yl)pyrazolo[3,4-c]pyridin-3-yl]ethanone;1-[1-(2,2-dimethylpropyl)-5-(2-methylpyrimidin-5-yl)pyrrolo[2,3-c]pyridin-3-yl]-2,2,2-trifluoroethanone
CID 160092688
(2S,4R)-1-[2-[3-acetyl-5-(2-methylpyrimidin-5-yl)indazol-1-yl]acetyl]-N-(6-bromo-2-pyridinyl)-4-fluoropyrrolidine-2-carboxamide;(2S,4R)-1-[2-[3-acetyl-5-(2-methylpyrimidin-5-yl)indazol-1-yl]acetyl]-4-fluoro-N-(6-methyl-2-pyridinyl)pyrrolidine-2-carboxamide;(2S,4R)-1-[2-[3-acetyl-5-(2-methylpyrimidin-5-yl)indazol-1-yl]acetyl]-4-fluoro-N-[6-(trifluoromethyl)pyrazin-2-yl]pyrrolidine-2-carboxamide
CID 160582105
(4-methylpiperazin-1-yl)-(2-propan-2-yl-3H-indol-5-yl)methanone;1-methyl-2-propan-2-ylbenzimidazole;2-methyl-1-propan-2-ylindole;bis(5-methyl-2-propan-2-yl-3H-indole);1-propan-2-ylimidazole;1-propan-2-ylindole;1-(2-propan-2-yl-3H-indol-5-yl)ethanone;1-(2-propan-2-yl-3H-indol-5-yl)hexan-1-one;1-propan-2-ylpyrazole;1-propan-2-ylpyrrole;2-propan-2-yl-3H-pyrrole;2-propan-2-yl-3H-pyrrolo[3,2-b]pyridine;2-propan-2-yl-6-(trifluoromethyl)-3H-indole
CID 161211844
3-bromo-4-methyl-N-[3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)phenyl]benzamide;2-[3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)phenyl]-1-[4-methyl-3-[(1-methyl-6-pyridin-3-ylpyrazolo[3,4-d]pyrimidin-4-yl)amino]phenyl]ethanone;1-methyl-6-pyridin-3-ylpyrazolo[3,4-d]pyrimidin-4-amine
CID 165024014
4-methyl-N-(3-methylphenyl)-3-[(2-methyl-6-pyrazin-2-ylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide;4-methyl-N-(3-methylphenyl)-3-[(1-methyl-6-pyridin-3-ylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide;4-methyl-N-(3-methylphenyl)-3-[(1-methyl-6-pyrimidin-5-ylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide;1-[4-methyl-3-[(1-methyl-6-pyridin-3-ylpyrazolo[3,4-d]pyrimidin-4-yl)amino]phenyl]-2-[3-(3-methylpyrrol-1-yl)-5-(trifluoromethyl)phenyl]ethanone
CID 165062219
4-[4-[1-Ethyl-3-(trifluoromethyl)pyrazol-5-yl]-1-methylimidazol-2-yl]-1-methylpyrazolo[4,3-c]pyridine-6-carboxamide;1-methyl-4-[1-methyl-4-(2-propan-2-ylpyrazol-3-yl)imidazol-2-yl]pyrazolo[4,3-c]pyridine-6-carboxamide;1-methyl-4-[1-methyl-4-(1-propylpyrazol-4-yl)imidazol-2-yl]pyrazolo[4,3-c]pyridine-6-carboxamide
CID 167611148

Frequently Asked Questions

What is the IUPAC name of 2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone?
The IUPAC name of 2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone (CID 143046911) is 2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone.
What is the SMILES notation for 2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone?
The canonical SMILES for 2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone is CCn1nc(C)c(Br)c1C(=O)Cc1c(-c2ccc(CCc3ccc4nc(-c5ccc(C)cc5)c(CC(=O)c5cc6ccccc6n5C)n4c3)cc2)nc2ccc(CCc3ccc(-c4nc5ccc(C)cn5c4CC(=O)c4nccn4C)cc3)cn12.
What is the InChIKey of 2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone?
The InChIKey is HDWJDXQKMDBULU-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H62BrN11O3/c1-7-82-69(65(71)45(4)76-82)60(84)38-57-67(75-64-33-24-49(42-81(57)64)18-16-47-21-29-52(30-22-47)68-58(39-61(85)70-72-34-35-77(70)5)79-40-44(3)14-31-62(79)73-68)51-27-19-46(20-28-51)15-17-48-23-32-63-74-66(50-25-12-43(2)13-26-50)56(80(63)41-48)37-59(83)55-36-53-10-8-9-11-54(53)78(55)6/h8-14,19-36,40-42H,7,15-18,37-39H2,1-6H3.
What are the key properties of 2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone?
2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone has a molecular weight of 1185.24 g/mol, XLogP of 13.61, 19 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[2-[4-[3-[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-2-oxoethyl]-6-[2-[4-[6-methyl-3-[2-(1-methylimidazol-2-yl)-2-oxoethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]imidazo[1,2-a]pyridin-2-yl]phenyl]ethyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(1-methylindol-2-yl)ethanone is sourced from PubChem (CID 143046911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).