2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum

C150H136N8O8Pt4-4 — CID 157354225

IUPAC2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum
SMILESCC(C)(C)c1cc(-c2[c-]c(-c3cc(-c4ccccc4)ccn3)ccc2)c2nc(-c3ccccc3O)oc2c1.CC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2cc(C(C)(C)C)cc3oc(-c4ccccc4O)nc23)c1.CC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2cccc3oc(-c4ccccc4O)nc23)c1.CC(C)c1cc(-c2cc(-c3cc(C(C)(C)C)ccn3)[c-]c(-c3cc(C(C)(C)C)cc4oc(-c5ccccc5O)nc34)c2)cc(C(C)C)c1.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C44H47N2O2.C38H35N2O2.2C34H27N2O2.4Pt/c1-26(2)28-17-29(27(3)4)19-30(18-28)31-20-32(22-33(21-31)38-24-34(15-16-45-38)43(5,6)7)37-23-35(44(8,9)10)25-40-41(37)46-42(48-40)36-13-11-12-14-39(36)47;1-37(2,3)28-19-26(18-27(20-28)32-21-25(16-17-39-32)24-12-8-7-9-13-24)31-22-29(38(4,5)6)23-34-35(31)40-36(42-34)30-14-10-11-15-33(30)41;1-34(2,3)26-20-28(32-31(21-26)38-33(36-32)27-14-7-8-15-30(27)37)24-12-9-13-25(18-24)29-19-23(16-17-35-29)22-10-5-4-6-11-22;1-34(2,3)26-19-24(18-25(20-26)29-21-23(16-17-35-29)22-10-5-4-6-11-22)27-13-9-15-31-32(27)36-33(38-31)28-12-7-8-14-30(28)37;;;;/h11-21,23-27,47H,1-10H3;7-17,19-23,41H,1-6H3;2*4-17,19-21,37H,1-3H3;;;;/q4*-1;;;;
InChIKeyPMUUGXDWHNWQLA-UHFFFAOYSA-N
MW2959.10 g/mol
LogP39.61
Rot. Bonds18

About 2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum

2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum (PubChem CID 157354225) has the molecular formula C150H136N8O8Pt4-4 and a molecular weight of 2959.10 g/mol. Its IUPAC name is 2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum.

Molecular Properties

Compound Name2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum
PubChem CID157354225
Molecular FormulaC150H136N8O8Pt4-4
Molecular Weight2959.10 g/mol
Exact Mass2956.91
IUPAC Name2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum
SMILESCC(C)(C)c1cc(-c2[c-]c(-c3cc(-c4ccccc4)ccn3)ccc2)c2nc(-c3ccccc3O)oc2c1.CC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2cc(C(C)(C)C)cc3oc(-c4ccccc4O)nc23)c1.CC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2cccc3oc(-c4ccccc4O)nc23)c1.CC(C)c1cc(-c2cc(-c3cc(C(C)(C)C)ccn3)[c-]c(-c3cc(C(C)(C)C)cc4oc(-c5ccccc5O)nc34)c2)cc(C(C)C)c1.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C44H47N2O2.C38H35N2O2.2C34H27N2O2.4Pt/c1-26(2)28-17-29(27(3)4)19-30(18-28)31-20-32(22-33(21-31)38-24-34(15-16-45-38)43(5,6)7)37-23-35(44(8,9)10)25-40-41(37)46-42(48-40)36-13-11-12-14-39(36)47;1-37(2,3)28-19-26(18-27(20-28)32-21-25(16-17-39-32)24-12-8-7-9-13-24)31-22-29(38(4,5)6)23-34-35(31)40-36(42-34)30-14-10-11-15-33(30)41;1-34(2,3)26-20-28(32-31(21-26)38-33(36-32)27-14-7-8-15-30(27)37)24-12-9-13-25(18-24)29-19-23(16-17-35-29)22-10-5-4-6-11-22;1-34(2,3)26-19-24(18-25(20-26)29-21-23(16-17-35-29)22-10-5-4-6-11-22)27-13-9-15-31-32(27)36-33(38-31)28-12-7-8-14-30(28)37;;;;/h11-21,23-27,47H,1-10H3;7-17,19-23,41H,1-6H3;2*4-17,19-21,37H,1-3H3;;;;/q4*-1;;;;
InChIKeyPMUUGXDWHNWQLA-UHFFFAOYSA-N
XLogP39.61
TPSA236.60 Ų
H-Bond Donors4
H-Bond Acceptors16
Rotatable Bonds18
Heavy Atoms170
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002959.10
LogP ≤ 539.61
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

Analyze 2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum?
The IUPAC name of 2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum (CID 157354225) is 2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum.
What is the SMILES notation for 2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum?
The canonical SMILES for 2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum is CC(C)(C)c1cc(-c2[c-]c(-c3cc(-c4ccccc4)ccn3)ccc2)c2nc(-c3ccccc3O)oc2c1.CC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2cc(C(C)(C)C)cc3oc(-c4ccccc4O)nc23)c1.CC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2cccc3oc(-c4ccccc4O)nc23)c1.CC(C)c1cc(-c2cc(-c3cc(C(C)(C)C)ccn3)[c-]c(-c3cc(C(C)(C)C)cc4oc(-c5ccccc5O)nc34)c2)cc(C(C)C)c1.[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of 2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum?
The InChIKey is PMUUGXDWHNWQLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H47N2O2.C38H35N2O2.2C34H27N2O2.4Pt/c1-26(2)28-17-29(27(3)4)19-30(18-28)31-20-32(22-33(21-31)38-24-34(15-16-45-38)43(5,6)7)37-23-35(44(8,9)10)25-40-41(37)46-42(48-40)36-13-11-12-14-39(36)47;1-37(2,3)28-19-26(18-27(20-28)32-21-25(16-17-39-32)24-12-8-7-9-13-24)31-22-29(38(4,5)6)23-34-35(31)40-36(42-34)30-14-10-11-15-33(30)41;1-34(2,3)26-20-28(32-31(21-26)38-33(36-32)27-14-7-8-15-30(27)37)24-12-9-13-25(18-24)29-19-23(16-17-35-29)22-10-5-4-6-11-22;1-34(2,3)26-19-24(18-25(20-26)29-21-23(16-17-35-29)22-10-5-4-6-11-22)27-13-9-15-31-32(27)36-33(38-31)28-12-7-8-14-30(28)37;;;;/h11-21,23-27,47H,1-10H3;7-17,19-23,41H,1-6H3;2*4-17,19-21,37H,1-3H3;;;;/q4*-1;;;;.
What are the key properties of 2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum?
2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum has a molecular weight of 2959.10 g/mol, XLogP of 39.61, 18 rotatable bonds, 4 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-tert-butyl-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[6-tert-butyl-4-[3-(4-phenyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum is sourced from PubChem (CID 157354225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).