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

C180H140BF36Ir4N33SSi — CID 159757052

IUPACdimethyl-[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
SMILESCc1cc(C)c(B(c2cccc(-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(c2cccc(-n3c4[c-]cc(C(F)(F)F)cc4c4cc(C)ccc43)n2)c2cc(C(F)(F)F)n[n-]2)c(C)c1.Cc1cc(C)n(-c2[c-]c(-n3nc(C)cc3C)cc(C(F)(F)F)c2)n1.Cc1cc(C)n(-c2[c-]c(-n3nc(C)cc3C)cc(C(F)(F)F)c2)n1.Cc1cc(C)n(-c2[c-]c(-n3nc(C)cc3C)cc(C(F)(F)F)c2)n1.Cc1cc(C)n(-c2[c-]c(-n3nc(C)cc3C)cc(C(F)(F)F)c2)n1.Cc1ccc2c(c1)c1cc(C(F)(F)F)c[c-]c1n2-c1cccc(Sc2cc(C(F)(F)F)n[n-]2)n1.Cc1ccc2c(c1)c1cc(C(F)(F)F)c[c-]c1n2-c1cccc([Si](C)(C)c2cc(C(F)(F)F)n[n-]2)n1.[Ir+3].[Ir+3].[Ir+3].[Ir+3]
InChIInChI=1S/C32H23BF6N4.C32H23F6N5.C25H18F6N4Si.C23H12F6N4S.4C17H16F3N4.4Ir/c1-17-8-10-24-22(14-17)23-15-21(31(34,35)36)9-11-25(23)43(24)29-7-5-6-27(40-29)33(28-16-26(41-42-28)32(37,38)39)30-19(3)12-18(2)13-20(30)4;1-17-8-10-24-22(14-17)23-15-21(31(33,34)35)9-11-25(23)42(24)27-6-5-7-28(39-27)43(29-16-26(40-41-29)32(36,37)38)30-19(3)12-18(2)13-20(30)4;1-14-7-9-18-16(11-14)17-12-15(24(26,27)28)8-10-19(17)35(18)21-5-4-6-22(32-21)36(2,3)23-13-20(33-34-23)25(29,30)31;1-12-5-7-16-14(9-12)15-10-13(22(24,25)26)6-8-17(15)33(16)19-3-2-4-20(30-19)34-21-11-18(31-32-21)23(27,28)29;4*1-10-5-12(3)23(21-10)15-7-14(17(18,19)20)8-16(9-15)24-13(4)6-11(2)22-24;;;;/h2*5-10,12-16H,1-4H3;4-9,11-13H,1-3H3;2-7,9-11H,1H3;4*5-8H,1-4H3;;;;/q4*-2;4*-1;4*+3
InChIKeyNGTHDEQEONPNRE-UHFFFAOYSA-N
MW4289.09 g/mol
LogP43.95
Rot. Bonds22

About 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

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 (PubChem CID 159757052) has the molecular formula C180H140BF36Ir4N33SSi and a molecular weight of 4289.09 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Namedimethyl-[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
PubChem CID159757052
Molecular FormulaC180H140BF36Ir4N33SSi
Molecular Weight4289.09 g/mol
Exact Mass4289.95
IUPAC Namedimethyl-[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
SMILESCc1cc(C)c(B(c2cccc(-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(c2cccc(-n3c4[c-]cc(C(F)(F)F)cc4c4cc(C)ccc43)n2)c2cc(C(F)(F)F)n[n-]2)c(C)c1.Cc1cc(C)n(-c2[c-]c(-n3nc(C)cc3C)cc(C(F)(F)F)c2)n1.Cc1cc(C)n(-c2[c-]c(-n3nc(C)cc3C)cc(C(F)(F)F)c2)n1.Cc1cc(C)n(-c2[c-]c(-n3nc(C)cc3C)cc(C(F)(F)F)c2)n1.Cc1cc(C)n(-c2[c-]c(-n3nc(C)cc3C)cc(C(F)(F)F)c2)n1.Cc1ccc2c(c1)c1cc(C(F)(F)F)c[c-]c1n2-c1cccc(Sc2cc(C(F)(F)F)n[n-]2)n1.Cc1ccc2c(c1)c1cc(C(F)(F)F)c[c-]c1n2-c1cccc([Si](C)(C)c2cc(C(F)(F)F)n[n-]2)n1.[Ir+3].[Ir+3].[Ir+3].[Ir+3]
InChIInChI=1S/C32H23BF6N4.C32H23F6N5.C25H18F6N4Si.C23H12F6N4S.4C17H16F3N4.4Ir/c1-17-8-10-24-22(14-17)23-15-21(31(34,35)36)9-11-25(23)43(24)29-7-5-6-27(40-29)33(28-16-26(41-42-28)32(37,38)39)30-19(3)12-18(2)13-20(30)4;1-17-8-10-24-22(14-17)23-15-21(31(33,34)35)9-11-25(23)42(24)27-6-5-7-28(39-27)43(29-16-26(40-41-29)32(36,37)38)30-19(3)12-18(2)13-20(30)4;1-14-7-9-18-16(11-14)17-12-15(24(26,27)28)8-10-19(17)35(18)21-5-4-6-22(32-21)36(2,3)23-13-20(33-34-23)25(29,30)31;1-12-5-7-16-14(9-12)15-10-13(22(24,25)26)6-8-17(15)33(16)19-3-2-4-20(30-19)34-21-11-18(31-32-21)23(27,28)29;4*1-10-5-12(3)23(21-10)15-7-14(17(18,19)20)8-16(9-15)24-13(4)6-11(2)22-24;;;;/h2*5-10,12-16H,1-4H3;4-9,11-13H,1-3H3;2-7,9-11H,1H3;4*5-8H,1-4H3;;;;/q4*-2;4*-1;4*+3
InChIKeyNGTHDEQEONPNRE-UHFFFAOYSA-N
XLogP43.95
TPSA325.04 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds22
Heavy Atoms256
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004289.09
LogP ≤ 543.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze 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 with MolForge

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Related Compounds

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);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
[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
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
CID 161394751
CID 161394751
CID 161467144
CID 161467144
5-[dimethyl-[6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]silyl]pyrazol-1-ide-3-carbonitrile;tetrakis(iridium);tetrakis(1-methyl-3-[3-(3-methyl-2H-imidazol-2-id-1-yl)-5-(trifluoromethyl)benzene-2-id-1-yl]-2H-imidazol-2-ide);5-[[6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]sulfanyl]pyrazol-1-ide-3-carbonitrile;5-[[6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]-(2,4,6-trimethylphenyl)boranyl]pyrazol-1-ide-3-carbonitrile;5-(2,4,6-trimethyl-N-[6-[6-methyl-3-(trifluoromethyl)-1H-carbazol-1-id-9-yl]-2-pyridinyl]anilino)pyrazol-1-ide-3-carbonitrile
CID 161994933

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is Cc1cc(C)c(B(c2cccc(-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(c2cccc(-n3c4[c-]cc(C(F)(F)F)cc4c4cc(C)ccc43)n2)c2cc(C(F)(F)F)n[n-]2)c(C)c1.Cc1cc(C)n(-c2[c-]c(-n3nc(C)cc3C)cc(C(F)(F)F)c2)n1.Cc1cc(C)n(-c2[c-]c(-n3nc(C)cc3C)cc(C(F)(F)F)c2)n1.Cc1cc(C)n(-c2[c-]c(-n3nc(C)cc3C)cc(C(F)(F)F)c2)n1.Cc1cc(C)n(-c2[c-]c(-n3nc(C)cc3C)cc(C(F)(F)F)c2)n1.Cc1ccc2c(c1)c1cc(C(F)(F)F)c[c-]c1n2-c1cccc(Sc2cc(C(F)(F)F)n[n-]2)n1.Cc1ccc2c(c1)c1cc(C(F)(F)F)c[c-]c1n2-c1cccc([Si](C)(C)c2cc(C(F)(F)F)n[n-]2)n1.[Ir+3].[Ir+3].[Ir+3].[Ir+3].
What is the InChIKey of 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?
The InChIKey is NGTHDEQEONPNRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H23BF6N4.C32H23F6N5.C25H18F6N4Si.C23H12F6N4S.4C17H16F3N4.4Ir/c1-17-8-10-24-22(14-17)23-15-21(31(34,35)36)9-11-25(23)43(24)29-7-5-6-27(40-29)33(28-16-26(41-42-28)32(37,38)39)30-19(3)12-18(2)13-20(30)4;1-17-8-10-24-22(14-17)23-15-21(31(33,34)35)9-11-25(23)42(24)27-6-5-7-28(39-27)43(29-16-26(40-41-29)32(36,37)38)30-19(3)12-18(2)13-20(30)4;1-14-7-9-18-16(11-14)17-12-15(24(26,27)28)8-10-19(17)35(18)21-5-4-6-22(32-21)36(2,3)23-13-20(33-34-23)25(29,30)31;1-12-5-7-16-14(9-12)15-10-13(22(24,25)26)6-8-17(15)33(16)19-3-2-4-20(30-19)34-21-11-18(31-32-21)23(27,28)29;4*1-10-5-12(3)23(21-10)15-7-14(17(18,19)20)8-16(9-15)24-13(4)6-11(2)22-24;;;;/h2*5-10,12-16H,1-4H3;4-9,11-13H,1-3H3;2-7,9-11H,1H3;4*5-8H,1-4H3;;;;/q4*-2;4*-1;4*+3.
What are the key properties of 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?
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 has a molecular weight of 4289.09 g/mol, XLogP of 43.95, 22 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 159757052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).