bis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+))

C138H94F6N45OPt5+ — CID 158023061

IUPACbis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+))
SMILESCc1c(-c2ccccc2)n[c-]n1-c1cccc(N(c2ccccc2)c2cccc(-n3[c-]nc(-c4ccccc4)c3C(F)(F)F)n2)n1.Cc1c(C(C)(C)C)n[c-]n1-c1cccc([N+](c2ccccc2)(c2ccccc2)c2cccc(-n3[c-]nc(C(C)(C)C)c3C)n2)n1.[C-]#[N+]c1n[c-]n(-c2cccc(C(=O)c3cccc(-n4[c-]nc(C#N)c4C(F)(F)F)n3)n2)c1C.[C-]#[N+]c1n[c-]n(-c2cccc(C(C)(C)c3cncc(-n4[c-]nc(C#N)c4C#N)n3)n2)c1[N+]#[C-].[C-]#[N+]c1n[c-]n(-c2cncc(C(C)(C)c3cncc(-n4[c-]nc(C#N)c4C#N)n3)n2)c1[N+]#[C-].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C38H40N7.C36H24F3N7.C22H11N11.C21H9F3N8O.C21H10N12.5Pt/c1-27-35(37(3,4)5)39-25-43(27)31-21-15-23-33(41-31)45(29-17-11-9-12-18-29,30-19-13-10-14-20-30)34-24-16-22-32(42-34)44-26-40-36(28(44)2)38(6,7)8;1-25-33(26-13-5-2-6-14-26)40-23-44(25)29-19-11-21-31(42-29)46(28-17-9-4-10-18-28)32-22-12-20-30(43-32)45-24-41-34(35(45)36(37,38)39)27-15-7-3-8-16-27;1-22(2,16-6-5-7-18(30-16)33-13-29-20(25-3)21(33)26-4)17-10-27-11-19(31-17)32-12-28-14(8-23)15(32)9-24;1-12-20(26-2)28-11-31(12)16-7-3-5-13(29-16)18(33)14-6-4-8-17(30-14)32-10-27-15(9-25)19(32)21(22,23)24;1-21(2,15-7-26-9-17(30-15)32-11-28-13(5-22)14(32)6-23)16-8-27-10-18(31-16)33-12-29-19(24-3)20(33)25-4;;;;;/h9-24H,1-8H3;2-22H,1H3;5-7,10-11H,1-2H3;3-8H,1H3;7-10H,1-2H3;;;;;/q-1;4*-2;5*+2
InChIKeyWBHSCZUEPCJXSY-UHFFFAOYSA-N
MW3487.96 g/mol
LogP26.38
Rot. Bonds25

About bis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+))

bis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+)) (PubChem CID 158023061) has the molecular formula C138H94F6N45OPt5+ and a molecular weight of 3487.96 g/mol. Its IUPAC name is bis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+)).

Molecular Properties

Compound Namebis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+))
PubChem CID158023061
Molecular FormulaC138H94F6N45OPt5+
Molecular Weight3487.96 g/mol
Exact Mass3485.68
IUPAC Namebis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+))
SMILESCc1c(-c2ccccc2)n[c-]n1-c1cccc(N(c2ccccc2)c2cccc(-n3[c-]nc(-c4ccccc4)c3C(F)(F)F)n2)n1.Cc1c(C(C)(C)C)n[c-]n1-c1cccc([N+](c2ccccc2)(c2ccccc2)c2cccc(-n3[c-]nc(C(C)(C)C)c3C)n2)n1.[C-]#[N+]c1n[c-]n(-c2cccc(C(=O)c3cccc(-n4[c-]nc(C#N)c4C(F)(F)F)n3)n2)c1C.[C-]#[N+]c1n[c-]n(-c2cccc(C(C)(C)c3cncc(-n4[c-]nc(C#N)c4C#N)n3)n2)c1[N+]#[C-].[C-]#[N+]c1n[c-]n(-c2cncc(C(C)(C)c3cncc(-n4[c-]nc(C#N)c4C#N)n3)n2)c1[N+]#[C-].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C38H40N7.C36H24F3N7.C22H11N11.C21H9F3N8O.C21H10N12.5Pt/c1-27-35(37(3,4)5)39-25-43(27)31-21-15-23-33(41-31)45(29-17-11-9-12-18-29,30-19-13-10-14-20-30)34-24-16-22-32(42-34)44-26-40-36(28(44)2)38(6,7)8;1-25-33(26-13-5-2-6-14-26)40-23-44(25)29-19-11-21-31(42-29)46(28-17-9-4-10-18-28)32-22-12-20-30(43-32)45-24-41-34(35(45)36(37,38)39)27-15-7-3-8-16-27;1-22(2,16-6-5-7-18(30-16)33-13-29-20(25-3)21(33)26-4)17-10-27-11-19(31-17)32-12-28-14(8-23)15(32)9-24;1-12-20(26-2)28-11-31(12)16-7-3-5-13(29-16)18(33)14-6-4-8-17(30-14)32-10-27-15(9-25)19(32)21(22,23)24;1-21(2,15-7-26-9-17(30-15)32-11-28-13(5-22)14(32)6-23)16-8-27-10-18(31-16)33-12-29-19(24-3)20(33)25-4;;;;;/h9-24H,1-8H3;2-22H,1H3;5-7,10-11H,1-2H3;3-8H,1H3;7-10H,1-2H3;;;;;/q-1;4*-2;5*+2
InChIKeyWBHSCZUEPCJXSY-UHFFFAOYSA-N
XLogP26.38
TPSA506.83 Ų
H-Bond Donors
H-Bond Acceptors40
Rotatable Bonds25
Heavy Atoms195
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003487.96
LogP ≤ 526.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1040

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

Analyze bis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+)) with MolForge

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Launch Full Analysis

Related Compounds

CID 157279305
CID 157279305
2-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-6-[[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylmethyl]pyridine;2-(4,5-difluoro-2H-imidazol-2-id-1-yl)-6-[[6-(4,5-difluoro-2H-imidazol-2-id-1-yl)-2-pyridinyl]methyl]pyridine;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;methane;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+))
CID 157376174
6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-N-[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;[6-(3-tert-butyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]-[2-(3-tert-butyl-5H-pyrazol-5-id-1-yl)pyrimidin-4-yl]methanone;1-[6-[cyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[difluoro-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(3H-pyrazol-3-id-2-yl)-6-[[6-(3H-pyrazol-3-id-2-yl)-2-pyridinyl]methyl]pyridine
CID 157586342
CID 157809928
CID 157809928
1-[4-[2-[6-(2H-benzimidazol-2-id-1-yl)-2-pyridinyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]pyrimidin-2-yl]-2H-benzimidazol-2-ide;3-[6-[[6-(2H-imidazo[4,5-b]pyrazin-2-id-3-yl)pyrazin-2-yl]-diphenylmethyl]pyrazin-2-yl]-2H-imidazo[4,5-b]pyrazin-2-ide;9-[6-[1-isocyano-1-[6-(6-methyl-8H-purin-8-id-9-yl)-2-pyridinyl]ethyl]-2-pyridinyl]-6-methyl-8H-purin-8-ide;tetrakis(platinum(2+));7-[6-[3-[6-(8H-purin-8-id-7-yl)-2-pyridinyl]propyl]-2-pyridinyl]-8H-purin-8-ide
CID 158605076
CID 158671554
CID 158671554
bis(6-phenyl-2-pyridinyl)methanone;3-[6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;2,6-difluoro-3-[6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;2-phenyl-6-[1-(6-phenyl-2-pyridinyl)ethenyl]pyridine;N-phenyl-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;pentakis(platinum(2+))
CID 158888944
2-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-6-[[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylmethyl]pyridine;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-[4-isocyano-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;N-phenyl-6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+))
CID 159095898
CID 159194705
CID 159194705
CID 159797852
CID 159797852
(5aR,6R,9aS)-2-benzyl-3-(3-fluorophenyl)-6,9a-dimethyl-7-oxo-4,5,5a,6-tetrahydrobenzo[e]benzimidazole-8-carbonitrile;(5aR,6R,9aS)-2-(2-cyclopropyl-4-pyridinyl)-3-(3-fluorophenyl)-6,9a-dimethyl-7-oxo-4,5,5a,6-tetrahydrobenzo[e]benzimidazole-8-carbonitrile;(5aR,6R,9aS)-2-(6-cyclopropyl-3-pyridinyl)-3-(3-fluorophenyl)-6,9a-dimethyl-7-oxo-4,5,5a,6-tetrahydrobenzo[e]benzimidazole-8-carbonitrile;(5aR,6R,9aS)-3-(3-fluorophenyl)-6,9a-dimethyl-7-oxo-2-(3-piperidin-1-ylphenyl)-4,5,5a,6-tetrahydrobenzo[e]benzimidazole-8-carbonitrile;(5aR,6R,9aS)-3-(3-fluorophenyl)-6,9a-dimethyl-7-oxo-2-(2-piperidin-1-yl-4-pyridinyl)-4,5,5a,6-tetrahydrobenzo[e]benzimidazole-8-carbonitrile;(5aR,6R,9aS)-3-(3-fluorophenyl)-6,9a-dimethyl-7-oxo-2-[2-(trifluoromethyl)-4-pyridinyl]-4,5,5a,6-tetrahydrobenzo[e]benzimidazole-8-carbonitrile
CID 160102535
CID 160231068
CID 160231068

Frequently Asked Questions

What is the IUPAC name of bis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+))?
The IUPAC name of bis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+)) (CID 158023061) is bis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+)).
What is the SMILES notation for bis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+))?
The canonical SMILES for bis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+)) is Cc1c(-c2ccccc2)n[c-]n1-c1cccc(N(c2ccccc2)c2cccc(-n3[c-]nc(-c4ccccc4)c3C(F)(F)F)n2)n1.Cc1c(C(C)(C)C)n[c-]n1-c1cccc([N+](c2ccccc2)(c2ccccc2)c2cccc(-n3[c-]nc(C(C)(C)C)c3C)n2)n1.[C-]#[N+]c1n[c-]n(-c2cccc(C(=O)c3cccc(-n4[c-]nc(C#N)c4C(F)(F)F)n3)n2)c1C.[C-]#[N+]c1n[c-]n(-c2cccc(C(C)(C)c3cncc(-n4[c-]nc(C#N)c4C#N)n3)n2)c1[N+]#[C-].[C-]#[N+]c1n[c-]n(-c2cncc(C(C)(C)c3cncc(-n4[c-]nc(C#N)c4C#N)n3)n2)c1[N+]#[C-].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of bis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+))?
The InChIKey is WBHSCZUEPCJXSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H40N7.C36H24F3N7.C22H11N11.C21H9F3N8O.C21H10N12.5Pt/c1-27-35(37(3,4)5)39-25-43(27)31-21-15-23-33(41-31)45(29-17-11-9-12-18-29,30-19-13-10-14-20-30)34-24-16-22-32(42-34)44-26-40-36(28(44)2)38(6,7)8;1-25-33(26-13-5-2-6-14-26)40-23-44(25)29-19-11-21-31(42-29)46(28-17-9-4-10-18-28)32-22-12-20-30(43-32)45-24-41-34(35(45)36(37,38)39)27-15-7-3-8-16-27;1-22(2,16-6-5-7-18(30-16)33-13-29-20(25-3)21(33)26-4)17-10-27-11-19(31-17)32-12-28-14(8-23)15(32)9-24;1-12-20(26-2)28-11-31(12)16-7-3-5-13(29-16)18(33)14-6-4-8-17(30-14)32-10-27-15(9-25)19(32)21(22,23)24;1-21(2,15-7-26-9-17(30-15)32-11-28-13(5-22)14(32)6-23)16-8-27-10-18(31-16)33-12-29-19(24-3)20(33)25-4;;;;;/h9-24H,1-8H3;2-22H,1H3;5-7,10-11H,1-2H3;3-8H,1H3;7-10H,1-2H3;;;;;/q-1;4*-2;5*+2.
What are the key properties of bis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+))?
bis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+)) has a molecular weight of 3487.96 g/mol, XLogP of 26.38, 25 rotatable bonds, 0 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for bis[6-(4-tert-butyl-5-methyl-2H-imidazol-2-id-1-yl)-2-pyridinyl]-diphenylazanium;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)pyrazin-2-yl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[2-[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyrazin-2-yl]-2H-imidazol-2-ide-4,5-dicarbonitrile;1-[6-[6-(4-isocyano-5-methyl-2H-imidazol-2-id-1-yl)pyridine-2-carbonyl]-2-pyridinyl]-5-(trifluoromethyl)-2H-imidazol-2-ide-4-carbonitrile;6-(5-methyl-4-phenyl-2H-imidazol-2-id-1-yl)-N-phenyl-N-[6-[4-phenyl-5-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]pyridin-2-amine;pentakis(platinum(2+)) is sourced from PubChem (CID 158023061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).