2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+))

C113H94F4N10O2Pt4S — CID 159943364

IUPAC2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+))
SMILESCC(C)(C)c1cc(-c2cc(C(C)(C)C)cc(-c3ccccc3O)n2)nc(-c2ccccc2O)c1.CC(C)(c1[c-]c(-c2cccc(-c3[c-]cccc3)n2)ccc1)c1nc2ccccc2s1.CC(C)(c1[c-]cccc1)c1cccc(-c2[c-]c(-c3ccccn3)c(F)cc2F)n1.Cn1c(-c2[c-]c(-c3nc4c(C(C)(C)c5[c-]cc(F)cc5F)cccc4n3C)ccc2)nc2ccccc21.[Pt+2].[Pt+2].[Pt+2].[Pt]
InChIInChI=1S/C31H24F2N4.C30H32N2O2.C27H20N2S.C25H18F2N2.4Pt/c1-31(2,22-16-15-21(32)18-24(22)33)23-11-8-14-27-28(23)35-30(37(27)4)20-10-7-9-19(17-20)29-34-25-12-5-6-13-26(25)36(29)3;1-29(2,3)19-15-23(21-11-7-9-13-27(21)33)31-25(17-19)26-18-20(30(4,5)6)16-24(32-26)22-12-8-10-14-28(22)34;1-27(2,26-29-24-14-6-7-17-25(24)30-26)21-13-8-12-20(18-21)23-16-9-15-22(28-23)19-10-4-3-5-11-19;1-25(2,17-9-4-3-5-10-17)24-13-8-12-23(29-24)19-15-18(20(26)16-21(19)27)22-11-6-7-14-28-22;;;;/h5-15,18H,1-4H3;7-18,33-34H,1-6H3;3-10,12-17H,1-2H3;3-9,11-14,16H,1-2H3;;;;/q-2;;2*-2;;3*+2
InChIKeyZZAWUFKFIJPZPE-UHFFFAOYSA-N
MW2512.43 g/mol
LogP27.44
Rot. Bonds15

About 2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+))

2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+)) (PubChem CID 159943364) has the molecular formula C113H94F4N10O2Pt4S and a molecular weight of 2512.43 g/mol. Its IUPAC name is 2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+)).

Molecular Properties

Compound Name2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+))
PubChem CID159943364
Molecular FormulaC113H94F4N10O2Pt4S
Molecular Weight2512.43 g/mol
Exact Mass2510.58
IUPAC Name2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+))
SMILESCC(C)(C)c1cc(-c2cc(C(C)(C)C)cc(-c3ccccc3O)n2)nc(-c2ccccc2O)c1.CC(C)(c1[c-]c(-c2cccc(-c3[c-]cccc3)n2)ccc1)c1nc2ccccc2s1.CC(C)(c1[c-]cccc1)c1cccc(-c2[c-]c(-c3ccccn3)c(F)cc2F)n1.Cn1c(-c2[c-]c(-c3nc4c(C(C)(C)c5[c-]cc(F)cc5F)cccc4n3C)ccc2)nc2ccccc21.[Pt+2].[Pt+2].[Pt+2].[Pt]
InChIInChI=1S/C31H24F2N4.C30H32N2O2.C27H20N2S.C25H18F2N2.4Pt/c1-31(2,22-16-15-21(32)18-24(22)33)23-11-8-14-27-28(23)35-30(37(27)4)20-10-7-9-19(17-20)29-34-25-12-5-6-13-26(25)36(29)3;1-29(2,3)19-15-23(21-11-7-9-13-27(21)33)31-25(17-19)26-18-20(30(4,5)6)16-24(32-26)22-12-8-10-14-28(22)34;1-27(2,26-29-24-14-6-7-17-25(24)30-26)21-13-8-12-20(18-21)23-16-9-15-22(28-23)19-10-4-3-5-11-19;1-25(2,17-9-4-3-5-10-17)24-13-8-12-23(29-24)19-15-18(20(26)16-21(19)27)22-11-6-7-14-28-22;;;;/h5-15,18H,1-4H3;7-18,33-34H,1-6H3;3-10,12-17H,1-2H3;3-9,11-14,16H,1-2H3;;;;/q-2;;2*-2;;3*+2
InChIKeyZZAWUFKFIJPZPE-UHFFFAOYSA-N
XLogP27.44
TPSA153.44 Ų
H-Bond Donors2
H-Bond Acceptors13
Rotatable Bonds15
Heavy Atoms134
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002512.43
LogP ≤ 527.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

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

Analyze 2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+)) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+))?
The IUPAC name of 2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+)) (CID 159943364) is 2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+)).
What is the SMILES notation for 2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+))?
The canonical SMILES for 2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+)) is CC(C)(C)c1cc(-c2cc(C(C)(C)C)cc(-c3ccccc3O)n2)nc(-c2ccccc2O)c1.CC(C)(c1[c-]c(-c2cccc(-c3[c-]cccc3)n2)ccc1)c1nc2ccccc2s1.CC(C)(c1[c-]cccc1)c1cccc(-c2[c-]c(-c3ccccn3)c(F)cc2F)n1.Cn1c(-c2[c-]c(-c3nc4c(C(C)(C)c5[c-]cc(F)cc5F)cccc4n3C)ccc2)nc2ccccc21.[Pt+2].[Pt+2].[Pt+2].[Pt].
What is the InChIKey of 2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+))?
The InChIKey is ZZAWUFKFIJPZPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24F2N4.C30H32N2O2.C27H20N2S.C25H18F2N2.4Pt/c1-31(2,22-16-15-21(32)18-24(22)33)23-11-8-14-27-28(23)35-30(37(27)4)20-10-7-9-19(17-20)29-34-25-12-5-6-13-26(25)36(29)3;1-29(2,3)19-15-23(21-11-7-9-13-27(21)33)31-25(17-19)26-18-20(30(4,5)6)16-24(32-26)22-12-8-10-14-28(22)34;1-27(2,26-29-24-14-6-7-17-25(24)30-26)21-13-8-12-20(18-21)23-16-9-15-22(28-23)19-10-4-3-5-11-19;1-25(2,17-9-4-3-5-10-17)24-13-8-12-23(29-24)19-15-18(20(26)16-21(19)27)22-11-6-7-14-28-22;;;;/h5-15,18H,1-4H3;7-18,33-34H,1-6H3;3-10,12-17H,1-2H3;3-9,11-14,16H,1-2H3;;;;/q-2;;2*-2;;3*+2.
What are the key properties of 2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+))?
2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+)) has a molecular weight of 2512.43 g/mol, XLogP of 27.44, 15 rotatable bonds, 2 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;4-[2-(2,4-difluorobenzene-6-id-1-yl)propan-2-yl]-1-methyl-2-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]benzimidazole;2-(2,4-difluoro-5-pyridin-2-ylbenzene-6-id-1-yl)-6-(2-phenylpropan-2-yl)pyridine;2-[2-[3-(6-phenyl-2-pyridinyl)benzene-2-id-1-yl]propan-2-yl]-1,3-benzothiazole;platinum;tris(platinum(2+)) is sourced from PubChem (CID 159943364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).