tris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine

C138H98N8O6Pt4 — CID 162019804

IUPACtris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine
SMILESCc1c[c-]c(-c2[c-]cc(C)cc2)cc1.Oc1ccccc1-c1ccccc1O.Oc1ccccc1-c1ccccc1O.Oc1ccccc1-c1ccccc1O.[Pt+2].[Pt+2].[Pt+2].[Pt+4].[c-]1c(-c2[c-]c(-c3ccccn3)ccc2)cccc1-c1ccccn1.[c-]1ccccc1-c1cccc(-c2[c-]c(-c3ccccn3)ccc2)n1.[c-]1ccccc1-c1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.[c-]1ccccc1-c1cccc(-c2cccc(-c3[c-]cccc3)n2)n1
InChIInChI=1S/4C22H14N2.C14H12.3C12H10O2.4Pt/c1-3-13-23-21(11-1)19-9-5-7-17(15-19)18-8-6-10-20(16-18)22-12-2-4-14-24-22;2*1-3-9-17(10-4-1)19-13-7-15-21(23-19)22-16-8-14-20(24-22)18-11-5-2-6-12-18;1-2-8-17(9-3-1)21-13-7-14-22(24-21)19-11-6-10-18(16-19)20-12-4-5-15-23-20;1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;3*13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14;;;;/h1-14H;2*1-9,11,13-16H;1-8,10-15H;3-7,9H,1-2H3;3*1-8,13-14H;;;;/q5*-2;;;;3*+2;+4
InChIKeyJPMRMVOXMHTICO-UHFFFAOYSA-N
MW2744.66 g/mol
LogP32.17
Rot. Bonds16

About tris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine

tris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine (PubChem CID 162019804) has the molecular formula C138H98N8O6Pt4 and a molecular weight of 2744.66 g/mol. Its IUPAC name is tris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine.

Molecular Properties

Compound Nametris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine
PubChem CID162019804
Molecular FormulaC138H98N8O6Pt4
Molecular Weight2744.66 g/mol
Exact Mass2742.62
IUPAC Nametris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine
SMILESCc1c[c-]c(-c2[c-]cc(C)cc2)cc1.Oc1ccccc1-c1ccccc1O.Oc1ccccc1-c1ccccc1O.Oc1ccccc1-c1ccccc1O.[Pt+2].[Pt+2].[Pt+2].[Pt+4].[c-]1c(-c2[c-]c(-c3ccccn3)ccc2)cccc1-c1ccccn1.[c-]1ccccc1-c1cccc(-c2[c-]c(-c3ccccn3)ccc2)n1.[c-]1ccccc1-c1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.[c-]1ccccc1-c1cccc(-c2cccc(-c3[c-]cccc3)n2)n1
InChIInChI=1S/4C22H14N2.C14H12.3C12H10O2.4Pt/c1-3-13-23-21(11-1)19-9-5-7-17(15-19)18-8-6-10-20(16-18)22-12-2-4-14-24-22;2*1-3-9-17(10-4-1)19-13-7-15-21(23-19)22-16-8-14-20(24-22)18-11-5-2-6-12-18;1-2-8-17(9-3-1)21-13-7-14-22(24-21)19-11-6-10-18(16-19)20-12-4-5-15-23-20;1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;3*13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14;;;;/h1-14H;2*1-9,11,13-16H;1-8,10-15H;3-7,9H,1-2H3;3*1-8,13-14H;;;;/q5*-2;;;;3*+2;+4
InChIKeyJPMRMVOXMHTICO-UHFFFAOYSA-N
XLogP32.17
TPSA224.50 Ų
H-Bond Donors6
H-Bond Acceptors14
Rotatable Bonds16
Heavy Atoms156
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002744.66
LogP ≤ 532.17
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

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

Analyze tris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of tris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine?
The IUPAC name of tris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine (CID 162019804) is tris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine.
What is the SMILES notation for tris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine?
The canonical SMILES for tris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine is Cc1c[c-]c(-c2[c-]cc(C)cc2)cc1.Oc1ccccc1-c1ccccc1O.Oc1ccccc1-c1ccccc1O.Oc1ccccc1-c1ccccc1O.[Pt+2].[Pt+2].[Pt+2].[Pt+4].[c-]1c(-c2[c-]c(-c3ccccn3)ccc2)cccc1-c1ccccn1.[c-]1ccccc1-c1cccc(-c2[c-]c(-c3ccccn3)ccc2)n1.[c-]1ccccc1-c1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.[c-]1ccccc1-c1cccc(-c2cccc(-c3[c-]cccc3)n2)n1.
What is the InChIKey of tris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine?
The InChIKey is JPMRMVOXMHTICO-UHFFFAOYSA-N. The full InChI is InChI=1S/4C22H14N2.C14H12.3C12H10O2.4Pt/c1-3-13-23-21(11-1)19-9-5-7-17(15-19)18-8-6-10-20(16-18)22-12-2-4-14-24-22;2*1-3-9-17(10-4-1)19-13-7-15-21(23-19)22-16-8-14-20(24-22)18-11-5-2-6-12-18;1-2-8-17(9-3-1)21-13-7-14-22(24-21)19-11-6-10-18(16-19)20-12-4-5-15-23-20;1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;3*13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14;;;;/h1-14H;2*1-9,11,13-16H;1-8,10-15H;3-7,9H,1-2H3;3*1-8,13-14H;;;;/q5*-2;;;;3*+2;+4.
What are the key properties of tris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine?
tris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine has a molecular weight of 2744.66 g/mol, XLogP of 32.17, 16 rotatable bonds, 6 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for tris(2-(2-hydroxyphenyl)phenol);1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;bis(2-phenyl-6-(6-phenyl-2-pyridinyl)pyridine);2-phenyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;tris(platinum(2+));platinum(4+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]pyridine is sourced from PubChem (CID 162019804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).