2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum

C239H257BrIN16O4Pt2- — CID 162267573

IUPAC2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum
SMILESBrc1cccc(-n2cnc3ccccc32)c1.CC(C)(C)c1cc(-[n+]2cn(-c3cccc(Oc4ccc5c6ccccc6n(-c6cc(C(C)(C)c7cc(C(C)(C)C)cc(C(C)(C)C)c7)ccn6)c5c4)c3)c3ccccc32)cc(C(C)(C)C)c1.CC(C)(C)c1cc(C(C)(C)C)cc(C(C)(C)c2ccnc(-n3c4ccccc4c4ccc(O)cc43)c2)c1.CC(C)(C)c1cc(C(C)(C)C)cc(C(C)(C)c2ccnc(-n3c4ccccc4c4ccc(Oc5cccc(-n6cnc7ccccc76)c5)cc43)c2)c1.CC(C)(C)c1cc(N2[CH-]N(c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(C(C)(C)c5cc(C(C)(C)C)cc(C(C)(C)C)c5)ccn4)ccc3)c3ccccc32)cc(C(C)(C)C)c1.Cc1cc(C)c([I+]c2cc(C(C)(C)C)cc(C(C)(C)C)c2)c(C)c1.[Pt].[Pt]
InChIInChI=1S/C61H67N4O.C61H65N4O.C47H46N4O.C34H38N2O.C23H32I.C13H9BrN2.2Pt/c2*1-57(2,3)41-30-42(58(4,5)6)33-45(32-41)61(13,14)40-28-29-62-56(36-40)65-52-23-16-15-22-50(52)51-27-26-49(38-55(51)65)66-48-21-19-20-46(37-48)63-39-64(54-25-18-17-24-53(54)63)47-34-43(59(7,8)9)31-44(35-47)60(10,11)12;1-45(2,3)32-24-33(46(4,5)6)26-34(25-32)47(7,8)31-22-23-48-44(27-31)51-41-18-11-9-16-38(41)39-21-20-37(29-43(39)51)52-36-15-13-14-35(28-36)50-30-49-40-17-10-12-19-42(40)50;1-32(2,3)23-17-24(33(4,5)6)19-25(18-23)34(7,8)22-15-16-35-31(20-22)36-29-12-10-9-11-27(29)28-14-13-26(37)21-30(28)36;1-15-10-16(2)21(17(3)11-15)24-20-13-18(22(4,5)6)12-19(14-20)23(7,8)9;14-10-4-3-5-11(8-10)16-9-15-12-6-1-2-7-13(12)16;;/h15-39H,1-14H3;15-36,39H,1-14H3;9-30H,1-8H3;9-21,37H,1-8H3;10-14H,1-9H3;1-9H;;/q+1;-3;;;+1;;;
InChIKeyWKZLNUVNXSYFGD-UHFFFAOYSA-N
MW4014.76 g/mol
LogP60.36
Rot. Bonds26

About 2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum

2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum (PubChem CID 162267573) has the molecular formula C239H257BrIN16O4Pt2- and a molecular weight of 4014.76 g/mol. Its IUPAC name is 2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum.

Molecular Properties

Compound Name2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum
PubChem CID162267573
Molecular FormulaC239H257BrIN16O4Pt2-
Molecular Weight4014.76 g/mol
Exact Mass4010.79
IUPAC Name2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum
SMILESBrc1cccc(-n2cnc3ccccc32)c1.CC(C)(C)c1cc(-[n+]2cn(-c3cccc(Oc4ccc5c6ccccc6n(-c6cc(C(C)(C)c7cc(C(C)(C)C)cc(C(C)(C)C)c7)ccn6)c5c4)c3)c3ccccc32)cc(C(C)(C)C)c1.CC(C)(C)c1cc(C(C)(C)C)cc(C(C)(C)c2ccnc(-n3c4ccccc4c4ccc(O)cc43)c2)c1.CC(C)(C)c1cc(C(C)(C)C)cc(C(C)(C)c2ccnc(-n3c4ccccc4c4ccc(Oc5cccc(-n6cnc7ccccc76)c5)cc43)c2)c1.CC(C)(C)c1cc(N2[CH-]N(c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(C(C)(C)c5cc(C(C)(C)C)cc(C(C)(C)C)c5)ccn4)ccc3)c3ccccc32)cc(C(C)(C)C)c1.Cc1cc(C)c([I+]c2cc(C(C)(C)C)cc(C(C)(C)C)c2)c(C)c1.[Pt].[Pt]
InChIInChI=1S/C61H67N4O.C61H65N4O.C47H46N4O.C34H38N2O.C23H32I.C13H9BrN2.2Pt/c2*1-57(2,3)41-30-42(58(4,5)6)33-45(32-41)61(13,14)40-28-29-62-56(36-40)65-52-23-16-15-22-50(52)51-27-26-49(38-55(51)65)66-48-21-19-20-46(37-48)63-39-64(54-25-18-17-24-53(54)63)47-34-43(59(7,8)9)31-44(35-47)60(10,11)12;1-45(2,3)32-24-33(46(4,5)6)26-34(25-32)47(7,8)31-22-23-48-44(27-31)51-41-18-11-9-16-38(41)39-21-20-37(29-43(39)51)52-36-15-13-14-35(28-36)50-30-49-40-17-10-12-19-42(40)50;1-32(2,3)23-17-24(33(4,5)6)19-25(18-23)34(7,8)22-15-16-35-31(20-22)36-29-12-10-9-11-27(29)28-14-13-26(37)21-30(28)36;1-15-10-16(2)21(17(3)11-15)24-20-13-18(22(4,5)6)12-19(14-20)23(7,8)9;14-10-4-3-5-11(8-10)16-9-15-12-6-1-2-7-13(12)16;;/h15-39H,1-14H3;15-36,39H,1-14H3;9-30H,1-8H3;9-21,37H,1-8H3;10-14H,1-9H3;1-9H;;/q+1;-3;;;+1;;;
InChIKeyWKZLNUVNXSYFGD-UHFFFAOYSA-N
XLogP60.36
TPSA170.13 Ų
H-Bond Donors1
H-Bond Acceptors19
Rotatable Bonds26
Heavy Atoms263
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004014.76
LogP ≤ 560.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1019

Analyze 2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum with MolForge

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Launch Full Analysis

Related Compounds

7-[3-(benzimidazol-1-yl)phenoxy]-9-(4-tert-butyl-2-pyridinyl)carbazole-3-carbonitrile;benzonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-3-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methylbenzimidazol-3-ium-1-yl)phenoxy]carbazole-3-carbonitrile;deuteriomethanone;dichloroplatinum;iodomethane;platinum;iodide
CID 160966014
2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
CID 155651584
2-[3-[3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-6-(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;bis(2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-6-(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide);bis(2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-7-(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide);platinum
CID 161401638
2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-6-tert-butyl-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
CID 162449104
2-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
CID 162449146
5-(4-tert-butyl-2-pyridinyl)-11-phenyl-3-[3-[3-(2,4,6-trimethylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-4H-indolo[3,2-b]carbazol-4-ide;platinum
CID 176782964
2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-5,6-ditert-butyl-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
CID 162447201
2-[3-[3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-[3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-7-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;2-[3-[5-tert-butyl-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum
CID 160891155
9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-6-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum
CID 162449273
7-tert-butyl-2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
CID 162447134
2-[3-[3-[3,5-bis(2-phenylpropan-2-yl)phenyl]-5-tert-butyl-2H-benzimidazol-2-id-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
CID 162448755
2-[3-[3-(3-tert-butylphenyl)-5-(2-phenylpropan-2-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
CID 162449540

Frequently Asked Questions

What is the IUPAC name of 2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum?
The IUPAC name of 2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum (CID 162267573) is 2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum.
What is the SMILES notation for 2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum?
The canonical SMILES for 2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum is Brc1cccc(-n2cnc3ccccc32)c1.CC(C)(C)c1cc(-[n+]2cn(-c3cccc(Oc4ccc5c6ccccc6n(-c6cc(C(C)(C)c7cc(C(C)(C)C)cc(C(C)(C)C)c7)ccn6)c5c4)c3)c3ccccc32)cc(C(C)(C)C)c1.CC(C)(C)c1cc(C(C)(C)C)cc(C(C)(C)c2ccnc(-n3c4ccccc4c4ccc(O)cc43)c2)c1.CC(C)(C)c1cc(C(C)(C)C)cc(C(C)(C)c2ccnc(-n3c4ccccc4c4ccc(Oc5cccc(-n6cnc7ccccc76)c5)cc43)c2)c1.CC(C)(C)c1cc(N2[CH-]N(c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(C(C)(C)c5cc(C(C)(C)C)cc(C(C)(C)C)c5)ccn4)ccc3)c3ccccc32)cc(C(C)(C)C)c1.Cc1cc(C)c([I+]c2cc(C(C)(C)C)cc(C(C)(C)C)c2)c(C)c1.[Pt].[Pt].
What is the InChIKey of 2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum?
The InChIKey is WKZLNUVNXSYFGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H67N4O.C61H65N4O.C47H46N4O.C34H38N2O.C23H32I.C13H9BrN2.2Pt/c2*1-57(2,3)41-30-42(58(4,5)6)33-45(32-41)61(13,14)40-28-29-62-56(36-40)65-52-23-16-15-22-50(52)51-27-26-49(38-55(51)65)66-48-21-19-20-46(37-48)63-39-64(54-25-18-17-24-53(54)63)47-34-43(59(7,8)9)31-44(35-47)60(10,11)12;1-45(2,3)32-24-33(46(4,5)6)26-34(25-32)47(7,8)31-22-23-48-44(27-31)51-41-18-11-9-16-38(41)39-21-20-37(29-43(39)51)52-36-15-13-14-35(28-36)50-30-49-40-17-10-12-19-42(40)50;1-32(2,3)23-17-24(33(4,5)6)19-25(18-23)34(7,8)22-15-16-35-31(20-22)36-29-12-10-9-11-27(29)28-14-13-26(37)21-30(28)36;1-15-10-16(2)21(17(3)11-15)24-20-13-18(22(4,5)6)12-19(14-20)23(7,8)9;14-10-4-3-5-11(8-10)16-9-15-12-6-1-2-7-13(12)16;;/h15-39H,1-14H3;15-36,39H,1-14H3;9-30H,1-8H3;9-21,37H,1-8H3;10-14H,1-9H3;1-9H;;/q+1;-3;;;+1;;;.
What are the key properties of 2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum?
2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum has a molecular weight of 4014.76 g/mol, XLogP of 60.36, 26 rotatable bonds, 1 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;1-(3-bromophenyl)benzimidazole;2-[3-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]-1H-carbazol-1-ide;2-[3-[3-(3,5-ditert-butylphenyl)benzimidazol-3-ium-1-yl]phenoxy]-9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazole;9-[4-[2-(3,5-ditert-butylphenyl)propan-2-yl]-2-pyridinyl]carbazol-2-ol;(3,5-ditert-butylphenyl)-(2,4,6-trimethylphenyl)iodanium;platinum is sourced from PubChem (CID 162267573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).