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

C134H145N6O6Pt3-3 — CID 161060683

IUPAC2-[6-tert-butyl-4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum
SMILESCC(C)(C)c1cc(-c2ccnc(-c3[c-]c(-c4cc(C(C)(C)C)cc5oc(-c6ccccc6O)nc45)c(C(C)(C)C)cc3C(C)(C)C)c2)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2ccnc(-c3[c-]c(-c4cccc5oc(-c6ccccc6O)nc45)c(C(C)(C)C)cc3C(C)(C)C)c2)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2ccnc(-c3[c-]c(-c4cccc5oc(-c6ccccc6O)nc45)ccc3)c2)cc(C(C)(C)C)c1.[Pt].[Pt].[Pt]
InChIInChI=1S/C50H59N2O2.C46H51N2O2.C38H35N2O2.3Pt/c1-46(2,3)32-22-31(23-33(25-32)47(4,5)6)30-20-21-51-41(24-30)38-28-36(39(49(10,11)12)29-40(38)50(13,14)15)37-26-34(48(7,8)9)27-43-44(37)52-45(54-43)35-18-16-17-19-42(35)53;1-43(2,3)30-22-29(23-31(25-30)44(4,5)6)28-20-21-47-38(24-28)35-26-34(36(45(7,8)9)27-37(35)46(10,11)12)32-17-15-19-40-41(32)48-42(50-40)33-16-13-14-18-39(33)49;1-37(2,3)28-20-27(21-29(23-28)38(4,5)6)24-17-18-39-32(22-24)26-12-9-11-25(19-26)30-14-10-16-34-35(30)40-36(42-34)31-13-7-8-15-33(31)41;;;/h16-27,29,53H,1-15H3;13-25,27,49H,1-12H3;7-18,20-23,41H,1-6H3;;;/q3*-1;;;
InChIKeyYBGHXCVQVFPLNB-UHFFFAOYSA-N
MW2520.90 g/mol
LogP36.45
Rot. Bonds12

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

2-[6-tert-butyl-4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum (PubChem CID 161060683) has the molecular formula C134H145N6O6Pt3-3 and a molecular weight of 2520.90 g/mol. Its IUPAC name is 2-[6-tert-butyl-4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum.

Molecular Properties

Compound Name2-[6-tert-butyl-4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum
PubChem CID161060683
Molecular FormulaC134H145N6O6Pt3-3
Molecular Weight2520.90 g/mol
Exact Mass2519.02
IUPAC Name2-[6-tert-butyl-4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum
SMILESCC(C)(C)c1cc(-c2ccnc(-c3[c-]c(-c4cc(C(C)(C)C)cc5oc(-c6ccccc6O)nc45)c(C(C)(C)C)cc3C(C)(C)C)c2)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2ccnc(-c3[c-]c(-c4cccc5oc(-c6ccccc6O)nc45)c(C(C)(C)C)cc3C(C)(C)C)c2)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2ccnc(-c3[c-]c(-c4cccc5oc(-c6ccccc6O)nc45)ccc3)c2)cc(C(C)(C)C)c1.[Pt].[Pt].[Pt]
InChIInChI=1S/C50H59N2O2.C46H51N2O2.C38H35N2O2.3Pt/c1-46(2,3)32-22-31(23-33(25-32)47(4,5)6)30-20-21-51-41(24-30)38-28-36(39(49(10,11)12)29-40(38)50(13,14)15)37-26-34(48(7,8)9)27-43-44(37)52-45(54-43)35-18-16-17-19-42(35)53;1-43(2,3)30-22-29(23-31(25-30)44(4,5)6)28-20-21-47-38(24-28)35-26-34(36(45(7,8)9)27-37(35)46(10,11)12)32-17-15-19-40-41(32)48-42(50-40)33-16-13-14-18-39(33)49;1-37(2,3)28-20-27(21-29(23-28)38(4,5)6)24-17-18-39-32(22-24)26-12-9-11-25(19-26)30-14-10-16-34-35(30)40-36(42-34)31-13-7-8-15-33(31)41;;;/h16-27,29,53H,1-15H3;13-25,27,49H,1-12H3;7-18,20-23,41H,1-6H3;;;/q3*-1;;;
InChIKeyYBGHXCVQVFPLNB-UHFFFAOYSA-N
XLogP36.45
TPSA177.45 Ų
H-Bond Donors3
H-Bond Acceptors12
Rotatable Bonds12
Heavy Atoms149
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002520.90
LogP ≤ 536.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[6-tert-butyl-4-[3-tert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[3-tert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[6-tert-butyl-4-[3-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;2-[4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]phenol;platinum
CID 157126034
4-tert-butyl-2-[4-[3-tert-butyl-5-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]-6-(2-phenylpropan-2-yl)phenol;platinum
CID 164742530
2-[4-[3-tert-butyl-5-[6-[3-tert-butyl-5-[2-(2-hydroxyphenyl)-1,3-benzoxazol-4-yl]benzene-6-id-1-yl]pyrimidin-4-yl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum
CID 176622936
2-[4-[3-[4-(1-phenylethyl)-2-pyridinyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum
CID 164742269
2-[6-tert-butyl-4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]-4-phenylphenol;2-[6-tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1,3-benzothiazol-2-yl]-4-phenylphenol;2-[4-[3-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum
CID 157342245
4-tert-butyl-2-[6-tert-butyl-4-[3-(8-tert-butyl-1,5-naphthyridin-4-yl)benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum
CID 177110994
2-[4-[3-(6-tert-butylquinolin-8-yl)-5-pyridin-2-ylbenzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum
CID 177110792
2-[6-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-4-(3,5-ditert-butylphenyl)-2-pyridinyl]phenol;platinum
CID 162471850
2-[4-[3-(6-tert-butyl-4-phenylquinolin-8-yl)-5-methylbenzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum
CID 177110229
4-tert-butyl-2-[4-[3-[6-tert-butyl-4-(3,5-ditert-butylphenyl)quinolin-8-yl]benzene-2-id-1-yl]-6-(4-tert-butylphenyl)-1,3-benzoxazol-2-yl]phenol;platinum
CID 177110187
2-[4-[3-(6-tert-butyl-4-methylquinolin-8-yl)benzene-2-id-1-yl]-6-naphthalen-1-yl-1,3-benzoxazol-2-yl]phenol;platinum
CID 177110960
2-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]-4,6-bis(1-phenylethyl)phenol;platinum
CID 164743025

Frequently Asked Questions

What is the IUPAC name of 2-[6-tert-butyl-4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum?
The IUPAC name of 2-[6-tert-butyl-4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum (CID 161060683) is 2-[6-tert-butyl-4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-[4-(3,5-ditert-butylphenyl)-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-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum?
The canonical SMILES for 2-[6-tert-butyl-4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum is CC(C)(C)c1cc(-c2ccnc(-c3[c-]c(-c4cc(C(C)(C)C)cc5oc(-c6ccccc6O)nc45)c(C(C)(C)C)cc3C(C)(C)C)c2)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2ccnc(-c3[c-]c(-c4cccc5oc(-c6ccccc6O)nc45)c(C(C)(C)C)cc3C(C)(C)C)c2)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2ccnc(-c3[c-]c(-c4cccc5oc(-c6ccccc6O)nc45)ccc3)c2)cc(C(C)(C)C)c1.[Pt].[Pt].[Pt].
What is the InChIKey of 2-[6-tert-butyl-4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum?
The InChIKey is YBGHXCVQVFPLNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H59N2O2.C46H51N2O2.C38H35N2O2.3Pt/c1-46(2,3)32-22-31(23-33(25-32)47(4,5)6)30-20-21-51-41(24-30)38-28-36(39(49(10,11)12)29-40(38)50(13,14)15)37-26-34(48(7,8)9)27-43-44(37)52-45(54-43)35-18-16-17-19-42(35)53;1-43(2,3)30-22-29(23-31(25-30)44(4,5)6)28-20-21-47-38(24-28)35-26-34(36(45(7,8)9)27-37(35)46(10,11)12)32-17-15-19-40-41(32)48-42(50-40)33-16-13-14-18-39(33)49;1-37(2,3)28-20-27(21-29(23-28)38(4,5)6)24-17-18-39-32(22-24)26-12-9-11-25(19-26)30-14-10-16-34-35(30)40-36(42-34)31-13-7-8-15-33(31)41;;;/h16-27,29,53H,1-15H3;13-25,27,49H,1-12H3;7-18,20-23,41H,1-6H3;;;/q3*-1;;;.
What are the key properties of 2-[6-tert-butyl-4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum?
2-[6-tert-butyl-4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum has a molecular weight of 2520.90 g/mol, XLogP of 36.45, 12 rotatable bonds, 3 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-tert-butyl-4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[2,4-ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzoxazol-2-yl]phenol;2-[4-[3-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1,3-benzoxazol-2-yl]phenol;platinum is sourced from PubChem (CID 161060683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).