2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum

C187H151N13O4Pt4-4 — CID 158217540

About 2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum

2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum (PubChem CID 158217540) has the molecular formula C187H151N13O4Pt4-4 and a molecular weight of 3424.66 g/mol. Its IUPAC name is 2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum.

Molecular Properties

• Compound Name: 2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum
• PubChem CID: 158217540
• Molecular Formula: C187H151N13O4Pt4-4
• Molecular Weight: 3424.66 g/mol
• Exact Mass: 3422.06
• IUPAC Name: 2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum
• SMILES: CC(C)(C)c1cc(-c2cc(-c3[c-]c(N(c4ccccn4)c4cccc5ccccc45)cc(-c4ccccc4)c3)nc(-c3ccccc3O)c2)cc(C(C)(C)C)c1.CC(C)c1cc(-c2ccc(-c3[c-]c(N(c4ccccn4)c4cccc5ccccc45)cc(-c4ccccc4)c3)nc2-c2ccccc2O)cc(C(C)C)c1.Cc1cc(-c2cc(-c3[c-]c(N(c4ccccn4)c4cccc5ccccc45)ccc3)nc(-c3ccccc3O)c2)cc(C)n1.Cc1cccc(C)c1-c1cc(-c2[c-]c(N(c3ccccn3)c3cccc4ccccc34)cc(-c3ccccc3)c2)nc(-c2ccccc2O)c1.[Pt].[Pt].[Pt].[Pt]
• InChI: InChI=1S/C52H46N3O.C50H42N3O.C46H34N3O.C39H29N4O.4Pt/c1-51(2,3)41-28-38(29-42(34-41)52(4,5)6)39-32-46(54-47(33-39)45-22-12-13-24-49(45)56)40-27-37(35-17-8-7-9-18-35)30-43(31-40)55(50-25-14-15-26-53-50)48-23-16-20-36-19-10-11-21-44(36)48;1-33(2)37-27-38(34(3)4)29-40(28-37)44-24-25-46(52-50(44)45-20-10-11-22-48(45)54)41-30-39(35-15-6-5-7-16-35)31-42(32-41)53(49-23-12-13-26-51-49)47-21-14-18-36-17-8-9-19-43(36)47;1-31-14-12-15-32(2)46(31)37-29-41(48-42(30-37)40-21-8-9-23-44(40)50)36-26-35(33-16-4-3-5-17-33)27-38(28-36)49(45-24-10-11-25-47-45)43-22-13-19-34-18-6-7-20-39(34)43;1-26-21-30(22-27(2)41-26)31-24-35(42-36(25-31)34-16-5-6-18-38(34)44)29-13-9-14-32(23-29)43(39-19-7-8-20-40-39)37-17-10-12-28-11-3-4-15-33(28)37;;;;/h7-30,32-34,56H,1-6H3;5-31,33-34,54H,1-4H3;3-27,29-30,50H,1-2H3;3-22,24-25,44H,1-2H3;;;;/q4*-1
• InChIKey: DOXYQYDUVLRKPB-UHFFFAOYSA-N
• XLogP: 48.89
• TPSA: 209.89 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 17
• Rotatable Bonds: 29
• Heavy Atoms: 208
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3424.66
LogP ≤ 5	48.89
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum?

The IUPAC name of 2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum (CID 158217540) is 2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum.

What is the SMILES notation for 2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum?

The canonical SMILES for 2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum is CC(C)(C)c1cc(-c2cc(-c3[c-]c(N(c4ccccn4)c4cccc5ccccc45)cc(-c4ccccc4)c3)nc(-c3ccccc3O)c2)cc(C(C)(C)C)c1.CC(C)c1cc(-c2ccc(-c3[c-]c(N(c4ccccn4)c4cccc5ccccc45)cc(-c4ccccc4)c3)nc2-c2ccccc2O)cc(C(C)C)c1.Cc1cc(-c2cc(-c3[c-]c(N(c4ccccn4)c4cccc5ccccc45)ccc3)nc(-c3ccccc3O)c2)cc(C)n1.Cc1cccc(C)c1-c1cc(-c2[c-]c(N(c3ccccn3)c3cccc4ccccc34)cc(-c3ccccc3)c2)nc(-c2ccccc2O)c1.[Pt].[Pt].[Pt].[Pt].

What is the InChIKey of 2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum?

The InChIKey is DOXYQYDUVLRKPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H46N3O.C50H42N3O.C46H34N3O.C39H29N4O.4Pt/c1-51(2,3)41-28-38(29-42(34-41)52(4,5)6)39-32-46(54-47(33-39)45-22-12-13-24-49(45)56)40-27-37(35-17-8-7-9-18-35)30-43(31-40)55(50-25-14-15-26-53-50)48-23-16-20-36-19-10-11-21-44(36)48;1-33(2)37-27-38(34(3)4)29-40(28-37)44-24-25-46(52-50(44)45-20-10-11-22-48(45)54)41-30-39(35-15-6-5-7-16-35)31-42(32-41)53(49-23-12-13-26-51-49)47-21-14-18-36-17-8-9-19-43(36)47;1-31-14-12-15-32(2)46(31)37-29-41(48-42(30-37)40-21-8-9-23-44(40)50)36-26-35(33-16-4-3-5-17-33)27-38(28-36)49(45-24-10-11-25-47-45)43-22-13-19-34-18-6-7-20-39(34)43;1-26-21-30(22-27(2)41-26)31-24-35(42-36(25-31)34-16-5-6-18-38(34)44)29-13-9-14-32(23-29)43(39-19-7-8-20-40-39)37-17-10-12-28-11-3-4-15-33(28)37;;;;/h7-30,32-34,56H,1-6H3;5-31,33-34,54H,1-4H3;3-27,29-30,50H,1-2H3;3-22,24-25,44H,1-2H3;;;;/q4*-1;;;;.

What are the key properties of 2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum?

2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum has a molecular weight of 3424.66 g/mol, XLogP of 48.89, 29 rotatable bonds, 4 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum is sourced from PubChem (CID 158217540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).