bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum

C164H186N16O4Pt4Si3-4 — CID 159524409

IUPACbis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum
SMILESCc1cnc(-c2[c-]c(-c3nccc4c3nc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)n4C)cc(-c3ccccc3)c2)cc1-c1ccccc1.Cn1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)nc2c(-c3[c-]c(-c4ccc([Si](C)(C)C)cn4)cc(-c4ccccc4)c3)nccc21.Cn1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)nc2c(-c3[c-]c(-c4ccc([Si](C)(C)C)cn4)cc(C(C)(C)C)c3)nccc21.Cn1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)nc2c(-c3[c-]c(-c4ccc([Si](C)(C)C)cn4)cc(C(C)(C)C)c3)nccc21.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C45H43N4O.C41H45N4OSi.2C39H49N4OSi.4Pt/c1-28-27-47-38(26-35(28)30-17-13-10-14-18-30)32-21-31(29-15-11-9-12-16-29)22-33(23-32)40-41-39(19-20-46-40)49(8)43(48-41)36-24-34(44(2,3)4)25-37(42(36)50)45(5,6)7;1-40(2,3)30-23-32(38(46)33(24-30)41(4,5)6)39-44-37-35(45(39)7)18-19-42-36(37)29-21-27(26-14-12-11-13-15-26)20-28(22-29)34-17-16-31(25-43-34)47(8,9)10;2*1-37(2,3)26-19-24(31-15-14-28(23-41-31)45(11,12)13)18-25(20-26)33-34-32(16-17-40-33)43(10)36(42-34)29-21-27(38(4,5)6)22-30(35(29)44)39(7,8)9;;;;/h9-22,24-27,50H,1-8H3;11-21,23-25,46H,1-10H3;2*14-17,19-23,44H,1-13H3;;;;/q4*-1;;;;
InChIKeyYRCASYINCCPCPL-UHFFFAOYSA-N
MW3309.97 g/mol
LogP39.39
Rot. Bonds18

About bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum

bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum (PubChem CID 159524409) has the molecular formula C164H186N16O4Pt4Si3-4 and a molecular weight of 3309.97 g/mol. Its IUPAC name is bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum.

Molecular Properties

Compound Namebis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum
PubChem CID159524409
Molecular FormulaC164H186N16O4Pt4Si3-4
Molecular Weight3309.97 g/mol
Exact Mass3307.28
IUPAC Namebis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum
SMILESCc1cnc(-c2[c-]c(-c3nccc4c3nc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)n4C)cc(-c3ccccc3)c2)cc1-c1ccccc1.Cn1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)nc2c(-c3[c-]c(-c4ccc([Si](C)(C)C)cn4)cc(-c4ccccc4)c3)nccc21.Cn1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)nc2c(-c3[c-]c(-c4ccc([Si](C)(C)C)cn4)cc(C(C)(C)C)c3)nccc21.Cn1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)nc2c(-c3[c-]c(-c4ccc([Si](C)(C)C)cn4)cc(C(C)(C)C)c3)nccc21.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C45H43N4O.C41H45N4OSi.2C39H49N4OSi.4Pt/c1-28-27-47-38(26-35(28)30-17-13-10-14-18-30)32-21-31(29-15-11-9-12-16-29)22-33(23-32)40-41-39(19-20-46-40)49(8)43(48-41)36-24-34(44(2,3)4)25-37(42(36)50)45(5,6)7;1-40(2,3)30-23-32(38(46)33(24-30)41(4,5)6)39-44-37-35(45(39)7)18-19-42-36(37)29-21-27(26-14-12-11-13-15-26)20-28(22-29)34-17-16-31(25-43-34)47(8,9)10;2*1-37(2,3)26-19-24(31-15-14-28(23-41-31)45(11,12)13)18-25(20-26)33-34-32(16-17-40-33)43(10)36(42-34)29-21-27(38(4,5)6)22-30(35(29)44)39(7,8)9;;;;/h9-22,24-27,50H,1-8H3;11-21,23-25,46H,1-10H3;2*14-17,19-23,44H,1-13H3;;;;/q4*-1;;;;
InChIKeyYRCASYINCCPCPL-UHFFFAOYSA-N
XLogP39.39
TPSA255.32 Ų
H-Bond Donors4
H-Bond Acceptors20
Rotatable Bonds18
Heavy Atoms191
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003309.97
LogP ≤ 539.39
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum?
The IUPAC name of bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum (CID 159524409) is bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum.
What is the SMILES notation for bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum?
The canonical SMILES for bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum is Cc1cnc(-c2[c-]c(-c3nccc4c3nc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)n4C)cc(-c3ccccc3)c2)cc1-c1ccccc1.Cn1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)nc2c(-c3[c-]c(-c4ccc([Si](C)(C)C)cn4)cc(-c4ccccc4)c3)nccc21.Cn1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)nc2c(-c3[c-]c(-c4ccc([Si](C)(C)C)cn4)cc(C(C)(C)C)c3)nccc21.Cn1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)nc2c(-c3[c-]c(-c4ccc([Si](C)(C)C)cn4)cc(C(C)(C)C)c3)nccc21.[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum?
The InChIKey is YRCASYINCCPCPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H43N4O.C41H45N4OSi.2C39H49N4OSi.4Pt/c1-28-27-47-38(26-35(28)30-17-13-10-14-18-30)32-21-31(29-15-11-9-12-16-29)22-33(23-32)40-41-39(19-20-46-40)49(8)43(48-41)36-24-34(44(2,3)4)25-37(42(36)50)45(5,6)7;1-40(2,3)30-23-32(38(46)33(24-30)41(4,5)6)39-44-37-35(45(39)7)18-19-42-36(37)29-21-27(26-14-12-11-13-15-26)20-28(22-29)34-17-16-31(25-43-34)47(8,9)10;2*1-37(2,3)26-19-24(31-15-14-28(23-41-31)45(11,12)13)18-25(20-26)33-34-32(16-17-40-33)43(10)36(42-34)29-21-27(38(4,5)6)22-30(35(29)44)39(7,8)9;;;;/h9-22,24-27,50H,1-8H3;11-21,23-25,46H,1-10H3;2*14-17,19-23,44H,1-13H3;;;;/q4*-1;;;;.
What are the key properties of bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum?
bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum has a molecular weight of 3309.97 g/mol, XLogP of 39.39, 18 rotatable bonds, 4 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]-1-methylimidazo[4,5-c]pyridin-2-yl]phenol);2,4-ditert-butyl-6-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[1-methyl-4-[3-phenyl-5-(5-trimethylsilyl-2-pyridinyl)benzene-6-id-1-yl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum is sourced from PubChem (CID 159524409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).