2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum

C230H172N12O8Pt4-4 — CID 163780919

IUPAC2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum
SMILESCC(C)(C)c1cc(-c2nc3c(-c4[c-]c(-c5nccc6oc7c8ccccc8ccc7c56)cc(-c5ccccc5)c4)cccc3n2-c2ccccc2-c2ccccc2)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(-c2nc3c(-c4[c-]c(-c5nccc6oc7c8ccccc8ccc7c56)cc(C(C)(C)c5ccccc5)c4)cccc3n2-c2ccccc2-c2ccccc2)c(O)c(C(C)(C)C)c1.CC(C)(c1ccccc1)c1cc(-c2cccc3c2nc(-c2ccccc2O)n3-c2ccccc2-c2ccccc2)[c-]c(-c2nccc3oc4c5ccccc5ccc4c23)c1.Oc1ccccc1-c1nc2c(-c3[c-]c(-c4nccc5oc6c7ccccc7ccc6c45)cc(-c4ccccc4)c3)cccc2n1-c1ccccc1-c1ccccc1.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C63H54N3O2.C60H48N3O2.C55H38N3O2.C52H32N3O2.4Pt/c1-61(2,3)44-37-50(58(67)51(38-44)62(4,5)6)60-65-57-47(27-19-29-53(57)66(60)52-28-18-17-25-46(52)39-20-11-9-12-21-39)41-34-42(36-45(35-41)63(7,8)43-23-13-10-14-24-43)56-55-49-31-30-40-22-15-16-26-48(40)59(49)68-54(55)32-33-64-56;1-59(2,3)43-35-48(56(64)49(36-43)60(4,5)6)58-62-55-45(25-17-27-51(55)63(58)50-26-16-15-23-44(50)38-20-11-8-12-21-38)41-32-40(37-18-9-7-10-19-37)33-42(34-41)54-53-47-29-28-39-22-13-14-24-46(39)57(47)65-52(53)30-31-61-54;1-55(2,39-19-7-4-8-20-39)40-33-37(32-38(34-40)51-50-45-29-28-36-18-9-10-22-43(36)53(45)60-49(50)30-31-56-51)42-24-15-26-47-52(42)57-54(44-23-12-14-27-48(44)59)58(47)46-25-13-11-21-41(46)35-16-5-3-6-17-35;56-46-25-12-10-21-42(46)52-54-50-40(22-13-24-45(50)55(52)44-23-11-9-19-39(44)34-16-5-2-6-17-34)37-30-36(33-14-3-1-4-15-33)31-38(32-37)49-48-43-27-26-35-18-7-8-20-41(35)51(43)57-47(48)28-29-53-49;;;;/h9-33,35-38,67H,1-8H3;7-33,35-36,64H,1-6H3;3-31,33-34,59H,1-2H3;1-31,56H;;;;/q4*-1;;;;
InChIKeyLAADTXMRUHABCN-UHFFFAOYSA-N
MW4012.29 g/mol
LogP59.75
Rot. Bonds26

About 2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum

2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum (PubChem CID 163780919) has the molecular formula C230H172N12O8Pt4-4 and a molecular weight of 4012.29 g/mol. Its IUPAC name is 2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum.

Molecular Properties

Compound Name2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum
PubChem CID163780919
Molecular FormulaC230H172N12O8Pt4-4
Molecular Weight4012.29 g/mol
Exact Mass4009.20
IUPAC Name2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum
SMILESCC(C)(C)c1cc(-c2nc3c(-c4[c-]c(-c5nccc6oc7c8ccccc8ccc7c56)cc(-c5ccccc5)c4)cccc3n2-c2ccccc2-c2ccccc2)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(-c2nc3c(-c4[c-]c(-c5nccc6oc7c8ccccc8ccc7c56)cc(C(C)(C)c5ccccc5)c4)cccc3n2-c2ccccc2-c2ccccc2)c(O)c(C(C)(C)C)c1.CC(C)(c1ccccc1)c1cc(-c2cccc3c2nc(-c2ccccc2O)n3-c2ccccc2-c2ccccc2)[c-]c(-c2nccc3oc4c5ccccc5ccc4c23)c1.Oc1ccccc1-c1nc2c(-c3[c-]c(-c4nccc5oc6c7ccccc7ccc6c45)cc(-c4ccccc4)c3)cccc2n1-c1ccccc1-c1ccccc1.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C63H54N3O2.C60H48N3O2.C55H38N3O2.C52H32N3O2.4Pt/c1-61(2,3)44-37-50(58(67)51(38-44)62(4,5)6)60-65-57-47(27-19-29-53(57)66(60)52-28-18-17-25-46(52)39-20-11-9-12-21-39)41-34-42(36-45(35-41)63(7,8)43-23-13-10-14-24-43)56-55-49-31-30-40-22-15-16-26-48(40)59(49)68-54(55)32-33-64-56;1-59(2,3)43-35-48(56(64)49(36-43)60(4,5)6)58-62-55-45(25-17-27-51(55)63(58)50-26-16-15-23-44(50)38-20-11-8-12-21-38)41-32-40(37-18-9-7-10-19-37)33-42(34-41)54-53-47-29-28-39-22-13-14-24-46(39)57(47)65-52(53)30-31-61-54;1-55(2,39-19-7-4-8-20-39)40-33-37(32-38(34-40)51-50-45-29-28-36-18-9-10-22-43(36)53(45)60-49(50)30-31-56-51)42-24-15-26-47-52(42)57-54(44-23-12-14-27-48(44)59)58(47)46-25-13-11-21-41(46)35-16-5-3-6-17-35;56-46-25-12-10-21-42(46)52-54-50-40(22-13-24-45(50)55(52)44-23-11-9-19-39(44)34-16-5-2-6-17-34)37-30-36(33-14-3-1-4-15-33)31-38(32-37)49-48-43-27-26-35-18-7-8-20-41(35)51(43)57-47(48)28-29-53-49;;;;/h9-33,35-38,67H,1-8H3;7-33,35-36,64H,1-6H3;3-31,33-34,59H,1-2H3;1-31,56H;;;;/q4*-1;;;;
InChIKeyLAADTXMRUHABCN-UHFFFAOYSA-N
XLogP59.75
TPSA256.32 Ų
H-Bond Donors4
H-Bond Acceptors20
Rotatable Bonds26
Heavy Atoms254
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004012.29
LogP ≤ 559.75
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze 2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum?
The IUPAC name of 2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum (CID 163780919) is 2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum.
What is the SMILES notation for 2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum?
The canonical SMILES for 2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum is CC(C)(C)c1cc(-c2nc3c(-c4[c-]c(-c5nccc6oc7c8ccccc8ccc7c56)cc(-c5ccccc5)c4)cccc3n2-c2ccccc2-c2ccccc2)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(-c2nc3c(-c4[c-]c(-c5nccc6oc7c8ccccc8ccc7c56)cc(C(C)(C)c5ccccc5)c4)cccc3n2-c2ccccc2-c2ccccc2)c(O)c(C(C)(C)C)c1.CC(C)(c1ccccc1)c1cc(-c2cccc3c2nc(-c2ccccc2O)n3-c2ccccc2-c2ccccc2)[c-]c(-c2nccc3oc4c5ccccc5ccc4c23)c1.Oc1ccccc1-c1nc2c(-c3[c-]c(-c4nccc5oc6c7ccccc7ccc6c45)cc(-c4ccccc4)c3)cccc2n1-c1ccccc1-c1ccccc1.[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of 2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum?
The InChIKey is LAADTXMRUHABCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H54N3O2.C60H48N3O2.C55H38N3O2.C52H32N3O2.4Pt/c1-61(2,3)44-37-50(58(67)51(38-44)62(4,5)6)60-65-57-47(27-19-29-53(57)66(60)52-28-18-17-25-46(52)39-20-11-9-12-21-39)41-34-42(36-45(35-41)63(7,8)43-23-13-10-14-24-43)56-55-49-31-30-40-22-15-16-26-48(40)59(49)68-54(55)32-33-64-56;1-59(2,3)43-35-48(56(64)49(36-43)60(4,5)6)58-62-55-45(25-17-27-51(55)63(58)50-26-16-15-23-44(50)38-20-11-8-12-21-38)41-32-40(37-18-9-7-10-19-37)33-42(34-41)54-53-47-29-28-39-22-13-14-24-46(39)57(47)65-52(53)30-31-61-54;1-55(2,39-19-7-4-8-20-39)40-33-37(32-38(34-40)51-50-45-29-28-36-18-9-10-22-43(36)53(45)60-49(50)30-31-56-51)42-24-15-26-47-52(42)57-54(44-23-12-14-27-48(44)59)58(47)46-25-13-11-21-41(46)35-16-5-3-6-17-35;56-46-25-12-10-21-42(46)52-54-50-40(22-13-24-45(50)55(52)44-23-11-9-19-39(44)34-16-5-2-6-17-34)37-30-36(33-14-3-1-4-15-33)31-38(32-37)49-48-43-27-26-35-18-7-8-20-41(35)51(43)57-47(48)28-29-53-49;;;;/h9-33,35-38,67H,1-8H3;7-33,35-36,64H,1-6H3;3-31,33-34,59H,1-2H3;1-31,56H;;;;/q4*-1;;;;.
What are the key properties of 2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum?
2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum has a molecular weight of 4012.29 g/mol, XLogP of 59.75, 26 rotatable bonds, 4 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-phenylbenzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaen-12-yl)-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum is sourced from PubChem (CID 163780919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).