[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide

C188H167BF33Ir4N33SSi-20 — CID 160582927

IUPAC[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide
SMILESCN1C=CN(c2[c-]c(N3C=CN(C)[CH-]3)cc(C(F)(F)F)c2)[CH-]1.CN1C=CN(c2[c-]c(N3C=CN(C)[CH-]3)cc(C(F)(F)F)c2)[CH-]1.CN1C=CN(c2[c-]c(N3C=CN(C)[CH-]3)cc(C(F)(F)F)c2)[CH-]1.Cc1cc(C)c(B(c2cc(C(C)(C)C)cc(-n3c4[c-]cc(C(F)(F)F)cc4c4cc(C)ccc43)n2)c2cc(C(F)(F)F)n[n-]2)c(C)c1.Cc1cc(C)c(N(c2cc(C(C)(C)C)cc(-n3c4[c-]cc(C(F)(F)F)cc4c4cc(C)ccc43)n2)c2cc(C(F)(F)F)n[n-]2)c(C)c1.Cc1cc(N2C=CN(C)[CH-]2)[c-]c(N2C=CN(C)[CH-]2)c1.Cc1ccc2c(c1)c1cc(C(F)(F)F)c[c-]c1n2-c1cc(C(C)(C)C)cc(Sc2cc(C(F)(F)F)n[n-]2)n1.Cc1ccc2c(c1)c1cc(C(F)(F)F)c[c-]c1n2-c1cc(C(C)(C)C)cc([Si](C)(C)c2cc(C(F)(F)F)n[n-]2)n1.[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C36H31BF6N4.C36H31F6N5.C29H26F6N4Si.C27H20F6N4S.3C15H14F3N4.C15H17N4.4Ir/c1-19-8-10-27-25(14-19)26-15-23(35(38,39)40)9-11-28(26)47(27)32-17-24(34(5,6)7)16-30(44-32)37(31-18-29(45-46-31)36(41,42)43)33-21(3)12-20(2)13-22(33)4;1-19-8-10-27-25(14-19)26-15-23(35(37,38)39)9-11-28(26)46(27)30-16-24(34(5,6)7)17-31(43-30)47(32-18-29(44-45-32)36(40,41)42)33-21(3)12-20(2)13-22(33)4;1-16-7-9-21-19(11-16)20-12-17(28(30,31)32)8-10-22(20)39(21)24-13-18(27(2,3)4)14-25(36-24)40(5,6)26-15-23(37-38-26)29(33,34)35;1-14-5-7-19-17(9-14)18-10-15(26(28,29)30)6-8-20(18)37(19)22-11-16(25(2,3)4)12-23(34-22)38-24-13-21(35-36-24)27(31,32)33;3*1-19-3-5-21(10-19)13-7-12(15(16,17)18)8-14(9-13)22-6-4-20(2)11-22;1-13-8-14(18-6-4-16(2)11-18)10-15(9-13)19-7-5-17(3)12-19;;;;/h2*8-10,12-18H,1-7H3;7-9,11-15H,1-6H3;5-7,9-13H,1-4H3;3*3-8,10-11H,1-2H3;4-9,11-12H,1-3H3;;;;/q4*-2;4*-3;;;;
InChIKeyGENJLWYQTGHDII-UHFFFAOYSA-N
MW4355.40 g/mol
LogP44.75
Rot. Bonds22

About [4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide

[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide (PubChem CID 160582927) has the molecular formula C188H167BF33Ir4N33SSi-20 and a molecular weight of 4355.40 g/mol. Its IUPAC name is [4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide.

Molecular Properties

Compound Name[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide
PubChem CID160582927
Molecular FormulaC188H167BF33Ir4N33SSi-20
Molecular Weight4355.40 g/mol
Exact Mass4356.18
IUPAC Name[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide
SMILESCN1C=CN(c2[c-]c(N3C=CN(C)[CH-]3)cc(C(F)(F)F)c2)[CH-]1.CN1C=CN(c2[c-]c(N3C=CN(C)[CH-]3)cc(C(F)(F)F)c2)[CH-]1.CN1C=CN(c2[c-]c(N3C=CN(C)[CH-]3)cc(C(F)(F)F)c2)[CH-]1.Cc1cc(C)c(B(c2cc(C(C)(C)C)cc(-n3c4[c-]cc(C(F)(F)F)cc4c4cc(C)ccc43)n2)c2cc(C(F)(F)F)n[n-]2)c(C)c1.Cc1cc(C)c(N(c2cc(C(C)(C)C)cc(-n3c4[c-]cc(C(F)(F)F)cc4c4cc(C)ccc43)n2)c2cc(C(F)(F)F)n[n-]2)c(C)c1.Cc1cc(N2C=CN(C)[CH-]2)[c-]c(N2C=CN(C)[CH-]2)c1.Cc1ccc2c(c1)c1cc(C(F)(F)F)c[c-]c1n2-c1cc(C(C)(C)C)cc(Sc2cc(C(F)(F)F)n[n-]2)n1.Cc1ccc2c(c1)c1cc(C(F)(F)F)c[c-]c1n2-c1cc(C(C)(C)C)cc([Si](C)(C)c2cc(C(F)(F)F)n[n-]2)n1.[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C36H31BF6N4.C36H31F6N5.C29H26F6N4Si.C27H20F6N4S.3C15H14F3N4.C15H17N4.4Ir/c1-19-8-10-27-25(14-19)26-15-23(35(38,39)40)9-11-28(26)47(27)32-17-24(34(5,6)7)16-30(44-32)37(31-18-29(45-46-31)36(41,42)43)33-21(3)12-20(2)13-22(33)4;1-19-8-10-27-25(14-19)26-15-23(35(37,38)39)9-11-28(26)46(27)30-16-24(34(5,6)7)17-31(43-30)47(32-18-29(44-45-32)36(40,41)42)33-21(3)12-20(2)13-22(33)4;1-16-7-9-21-19(11-16)20-12-17(28(30,31)32)8-10-22(20)39(21)24-13-18(27(2,3)4)14-25(36-24)40(5,6)26-15-23(37-38-26)29(33,34)35;1-14-5-7-19-17(9-14)18-10-15(26(28,29)30)6-8-20(18)37(19)22-11-16(25(2,3)4)12-23(34-22)38-24-13-21(35-36-24)27(31,32)33;3*1-19-3-5-21(10-19)13-7-12(15(16,17)18)8-14(9-13)22-6-4-20(2)11-22;1-13-8-14(18-6-4-16(2)11-18)10-15(9-13)19-7-5-17(3)12-19;;;;/h2*8-10,12-18H,1-7H3;7-9,11-15H,1-6H3;5-7,9-13H,1-4H3;3*3-8,10-11H,1-2H3;4-9,11-12H,1-3H3;;;;/q4*-2;4*-3;;;;
InChIKeyGENJLWYQTGHDII-UHFFFAOYSA-N
XLogP44.75
TPSA234.32 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds22
Heavy Atoms261
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004355.40
LogP ≤ 544.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze [4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide with MolForge

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Launch Full Analysis

Related Compounds

2-[2-[4-(N-(4-tert-butylphenyl)anilino)-6-[3-phenyl-4-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]propan-2-yl]-6-(2-fluoro-4H-pyridin-4-id-3-yl)-N-(4-methylphenyl)-N-phenylpyridin-4-amine;N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-(5-phenyl-2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]-N-[4-(5-phenylhexan-3-yl)phenyl]pyridin-4-amine;tris(platinum(2+))
CID 157721725
tetrakis(3,5-bis(3-methyl-2H-imidazol-2-id-1-yl)benzene-4-ide-1-carbonitrile);[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;2,6-difluoro-3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-4H-pyridin-4-ide;tetrakis(iridium)
CID 157866258
tris(3,5-bis(3-methyl-2H-imidazol-2-id-1-yl)benzene-4-ide-1-carbonitrile);dimethyl-[4-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]pyrimidin-2-yl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;tris(iridium);[4-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]pyrimidin-2-yl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;6-methyl-3-(trifluoromethyl)-9-[2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanylpyrimidin-4-yl]-1H-carbazol-1-ide
CID 157941116
[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tris(iridium);bis(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide
CID 158298717
dimethyl-[6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;tris(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);[6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;6-methyl-3-(trifluoromethyl)-9-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-1H-carbazol-1-ide
CID 158433214
dimethyl-[6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;tris(1-[3-(3,5-dimethylpyrazol-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-3,5-dimethylpyrazole);tris(iridium(3+));[6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;6-methyl-3-(trifluoromethyl)-9-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-1H-carbazol-1-ide
CID 158475878
CID 158844182
CID 158844182
tris(3,5-bis(3-methyl-2H-imidazol-2-id-1-yl)benzene-4-ide-1-carbonitrile);[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;2,6-difluoro-3-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-4H-pyridin-4-ide;tris(iridium)
CID 159285588
2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-[difluoro-(4-fluorobenzene-6-id-1-yl)methyl]-2-pyridinyl]propan-2-yl]pyridine;6-[2-[6-[(2,4-difluorobenzene-6-id-1-yl)methyl]-2-pyridinyl]propan-2-yl]-8-phenyl-1,7-diazatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene;2-[[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-diphenylmethyl]-9-phenylpyrido[2,3-b]indole;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)-N,N-dimethyl-6-[2-(6-phenylsulfanyl-2-pyridinyl)propan-2-yl]pyridin-4-amine;tetrakis(platinum(2+))
CID 159291476
dimethyl-[6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;tetrakis(1-[3-(3,5-dimethylpyrazol-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-3,5-dimethylpyrazole);tetrakis(iridium(3+));[6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;6-methyl-3-(trifluoromethyl)-9-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-1H-carbazol-1-ide
CID 159757052
tris(3,5-bis(3-methyl-2H-imidazol-2-id-1-yl)benzene-4-ide-1-carbonitrile);9-[6-[dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silyl]-2-pyridinyl]-6-isocyano-1H-carbazol-1-ide-3-carbonitrile;tris(iridium);6-isocyano-9-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-1H-carbazol-1-ide-3-carbonitrile;6-isocyano-9-[6-[[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)boranyl]-2-pyridinyl]-1H-carbazol-1-ide-3-carbonitrile
CID 159960033
dimethyl-[6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]silane;tris(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);[6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]-(2,4,6-trimethylphenyl)borane;6-methyl-3-(trifluoromethyl)-9-[6-[[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]sulfanyl]-2-pyridinyl]-1H-carbazol-1-ide
CID 161054768

Frequently Asked Questions

What is the IUPAC name of [4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide?
The IUPAC name of [4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide (CID 160582927) is [4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide.
What is the SMILES notation for [4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide?
The canonical SMILES for [4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide is CN1C=CN(c2[c-]c(N3C=CN(C)[CH-]3)cc(C(F)(F)F)c2)[CH-]1.CN1C=CN(c2[c-]c(N3C=CN(C)[CH-]3)cc(C(F)(F)F)c2)[CH-]1.CN1C=CN(c2[c-]c(N3C=CN(C)[CH-]3)cc(C(F)(F)F)c2)[CH-]1.Cc1cc(C)c(B(c2cc(C(C)(C)C)cc(-n3c4[c-]cc(C(F)(F)F)cc4c4cc(C)ccc43)n2)c2cc(C(F)(F)F)n[n-]2)c(C)c1.Cc1cc(C)c(N(c2cc(C(C)(C)C)cc(-n3c4[c-]cc(C(F)(F)F)cc4c4cc(C)ccc43)n2)c2cc(C(F)(F)F)n[n-]2)c(C)c1.Cc1cc(N2C=CN(C)[CH-]2)[c-]c(N2C=CN(C)[CH-]2)c1.Cc1ccc2c(c1)c1cc(C(F)(F)F)c[c-]c1n2-c1cc(C(C)(C)C)cc(Sc2cc(C(F)(F)F)n[n-]2)n1.Cc1ccc2c(c1)c1cc(C(F)(F)F)c[c-]c1n2-c1cc(C(C)(C)C)cc([Si](C)(C)c2cc(C(F)(F)F)n[n-]2)n1.[Ir].[Ir].[Ir].[Ir].
What is the InChIKey of [4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide?
The InChIKey is GENJLWYQTGHDII-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H31BF6N4.C36H31F6N5.C29H26F6N4Si.C27H20F6N4S.3C15H14F3N4.C15H17N4.4Ir/c1-19-8-10-27-25(14-19)26-15-23(35(38,39)40)9-11-28(26)47(27)32-17-24(34(5,6)7)16-30(44-32)37(31-18-29(45-46-31)36(41,42)43)33-21(3)12-20(2)13-22(33)4;1-19-8-10-27-25(14-19)26-15-23(35(37,38)39)9-11-28(26)46(27)30-16-24(34(5,6)7)17-31(43-30)47(32-18-29(44-45-32)36(40,41)42)33-21(3)12-20(2)13-22(33)4;1-16-7-9-21-19(11-16)20-12-17(28(30,31)32)8-10-22(20)39(21)24-13-18(27(2,3)4)14-25(36-24)40(5,6)26-15-23(37-38-26)29(33,34)35;1-14-5-7-19-17(9-14)18-10-15(26(28,29)30)6-8-20(18)37(19)22-11-16(25(2,3)4)12-23(34-22)38-24-13-21(35-36-24)27(31,32)33;3*1-19-3-5-21(10-19)13-7-12(15(16,17)18)8-14(9-13)22-6-4-20(2)11-22;1-13-8-14(18-6-4-16(2)11-18)10-15(9-13)19-7-5-17(3)12-19;;;;/h2*8-10,12-18H,1-7H3;7-9,11-15H,1-6H3;5-7,9-13H,1-4H3;3*3-8,10-11H,1-2H3;4-9,11-12H,1-3H3;;;;/q4*-2;4*-3;;;;.
What are the key properties of [4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide?
[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide has a molecular weight of 4355.40 g/mol, XLogP of 44.75, 22 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for [4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-dimethyl-[3-(trifluoromethyl)pyrazol-1-id-5-yl]silane;[4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-(2,4,6-trimethylphenyl)borane;4-tert-butyl-6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-N-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-N-(2,4,6-trimethylphenyl)pyridin-2-amine;9-[4-tert-butyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]sulfanyl-2-pyridinyl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(iridium);tris(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);1-methyl-3-[3-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)benzene-6-id-1-yl]-2H-imidazol-2-ide is sourced from PubChem (CID 160582927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).