2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum

C72H70N3OPt- — CID 162782955

IUPAC2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum
SMILESCC(C)(C)c1ccc(-n2c(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)nc3c(-c4[c-]c(-c5cc(-c6ccc(C(C)(C)c7ccccc7)cc6)ccn5)c5c(c4)-c4ccccc4C5(C)C)cccc32)c(-c2ccccc2)c1.[Pt]
InChIInChI=1S/C72H70N3O.Pt/c1-68(2,3)51-35-36-62(55(42-51)46-23-16-14-17-24-46)75-63-30-22-28-53(65(63)74-67(75)58-43-52(69(4,5)6)44-60(66(58)76)70(7,8)9)48-39-56-54-27-20-21-29-59(54)72(12,13)64(56)57(40-48)61-41-47(37-38-73-61)45-31-33-50(34-32-45)71(10,11)49-25-18-15-19-26-49;/h14-39,41-44,76H,1-13H3;/q-1;
InChIKeyXSLIZMQGKOSQNP-UHFFFAOYSA-N
MW1188.45 g/mol
LogP18.78
Rot. Bonds8

About 2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum

2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum (PubChem CID 162782955) has the molecular formula C72H70N3OPt- and a molecular weight of 1188.45 g/mol. Its IUPAC name is 2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum.

Molecular Properties

Compound Name2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum
PubChem CID162782955
Molecular FormulaC72H70N3OPt-
Molecular Weight1188.45 g/mol
Exact Mass1187.52
IUPAC Name2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum
SMILESCC(C)(C)c1ccc(-n2c(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)nc3c(-c4[c-]c(-c5cc(-c6ccc(C(C)(C)c7ccccc7)cc6)ccn5)c5c(c4)-c4ccccc4C5(C)C)cccc32)c(-c2ccccc2)c1.[Pt]
InChIInChI=1S/C72H70N3O.Pt/c1-68(2,3)51-35-36-62(55(42-51)46-23-16-14-17-24-46)75-63-30-22-28-53(65(63)74-67(75)58-43-52(69(4,5)6)44-60(66(58)76)70(7,8)9)48-39-56-54-27-20-21-29-59(54)72(12,13)64(56)57(40-48)61-41-47(37-38-73-61)45-31-33-50(34-32-45)71(10,11)49-25-18-15-19-26-49;/h14-39,41-44,76H,1-13H3;/q-1;
InChIKeyXSLIZMQGKOSQNP-UHFFFAOYSA-N
XLogP18.78
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms77
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001188.45
LogP ≤ 518.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum?
The IUPAC name of 2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum (CID 162782955) is 2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum.
What is the SMILES notation for 2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum?
The canonical SMILES for 2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum is CC(C)(C)c1ccc(-n2c(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)nc3c(-c4[c-]c(-c5cc(-c6ccc(C(C)(C)c7ccccc7)cc6)ccn5)c5c(c4)-c4ccccc4C5(C)C)cccc32)c(-c2ccccc2)c1.[Pt].
What is the InChIKey of 2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum?
The InChIKey is XSLIZMQGKOSQNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H70N3O.Pt/c1-68(2,3)51-35-36-62(55(42-51)46-23-16-14-17-24-46)75-63-30-22-28-53(65(63)74-67(75)58-43-52(69(4,5)6)44-60(66(58)76)70(7,8)9)48-39-56-54-27-20-21-29-59(54)72(12,13)64(56)57(40-48)61-41-47(37-38-73-61)45-31-33-50(34-32-45)71(10,11)49-25-18-15-19-26-49;/h14-39,41-44,76H,1-13H3;/q-1;.
What are the key properties of 2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum?
2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum has a molecular weight of 1188.45 g/mol, XLogP of 18.78, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[9,9-dimethyl-1-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]-2H-fluoren-2-id-3-yl]benzimidazol-2-yl]phenol;platinum is sourced from PubChem (CID 162782955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).