8-[[6-[2-hydroxy-4-(2,4,6-trimethylphenyl)phenyl]-4-phenyl-2-pyridinyl]methylideneamino]naphthalen-1-ol;platinum

C37H30N2O2Pt — CID 155609993

About 8-[[6-[2-hydroxy-4-(2,4,6-trimethylphenyl)phenyl]-4-phenyl-2-pyridinyl]methylideneamino]naphthalen-1-ol;platinum

8-[[6-[2-hydroxy-4-(2,4,6-trimethylphenyl)phenyl]-4-phenyl-2-pyridinyl]methylideneamino]naphthalen-1-ol;platinum (PubChem CID 155609993) has the molecular formula C37H30N2O2Pt and a molecular weight of 729.74 g/mol. Its IUPAC name is 8-[[6-[2-hydroxy-4-(2,4,6-trimethylphenyl)phenyl]-4-phenyl-2-pyridinyl]methylideneamino]naphthalen-1-ol;platinum.

Molecular Properties

• Compound Name: 8-[[6-[2-hydroxy-4-(2,4,6-trimethylphenyl)phenyl]-4-phenyl-2-pyridinyl]methylideneamino]naphthalen-1-ol;platinum
• PubChem CID: 155609993
• Molecular Formula: C37H30N2O2Pt
• Molecular Weight: 729.74 g/mol
• Exact Mass: 729.20
• IUPAC Name: 8-[[6-[2-hydroxy-4-(2,4,6-trimethylphenyl)phenyl]-4-phenyl-2-pyridinyl]methylideneamino]naphthalen-1-ol;platinum
• SMILES: Cc1cc(C)c(-c2ccc(-c3cc(-c4ccccc4)cc(/C=N/c4cccc5cccc(O)c45)n3)c(O)c2)c(C)c1.[Pt]
• InChI: InChI=1S/C37H30N2O2.Pt/c1-23-17-24(2)36(25(3)18-23)28-15-16-31(35(41)21-28)33-20-29(26-9-5-4-6-10-26)19-30(39-33)22-38-32-13-7-11-27-12-8-14-34(40)37(27)32;/h4-22,40-41H,1-3H3;/b38-22+
• InChIKey: DADWCGVPORSOSV-UDIOAMHASA-N
• XLogP: 9.32
• TPSA: 65.71 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 42
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	729.74
LogP ≤ 5	9.32
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 8-[[6-[2-hydroxy-4-(2,4,6-trimethylphenyl)phenyl]-4-phenyl-2-pyridinyl]methylideneamino]naphthalen-1-ol;platinum?

The IUPAC name of 8-[[6-[2-hydroxy-4-(2,4,6-trimethylphenyl)phenyl]-4-phenyl-2-pyridinyl]methylideneamino]naphthalen-1-ol;platinum (CID 155609993) is 8-[[6-[2-hydroxy-4-(2,4,6-trimethylphenyl)phenyl]-4-phenyl-2-pyridinyl]methylideneamino]naphthalen-1-ol;platinum.

What is the SMILES notation for 8-[[6-[2-hydroxy-4-(2,4,6-trimethylphenyl)phenyl]-4-phenyl-2-pyridinyl]methylideneamino]naphthalen-1-ol;platinum?

The canonical SMILES for 8-[[6-[2-hydroxy-4-(2,4,6-trimethylphenyl)phenyl]-4-phenyl-2-pyridinyl]methylideneamino]naphthalen-1-ol;platinum is Cc1cc(C)c(-c2ccc(-c3cc(-c4ccccc4)cc(/C=N/c4cccc5cccc(O)c45)n3)c(O)c2)c(C)c1.[Pt].

What is the InChIKey of 8-[[6-[2-hydroxy-4-(2,4,6-trimethylphenyl)phenyl]-4-phenyl-2-pyridinyl]methylideneamino]naphthalen-1-ol;platinum?

The InChIKey is DADWCGVPORSOSV-UDIOAMHASA-N. The full InChI is InChI=1S/C37H30N2O2.Pt/c1-23-17-24(2)36(25(3)18-23)28-15-16-31(35(41)21-28)33-20-29(26-9-5-4-6-10-26)19-30(39-33)22-38-32-13-7-11-27-12-8-14-34(40)37(27)32;/h4-22,40-41H,1-3H3;/b38-22+;.

What are the key properties of 8-[[6-[2-hydroxy-4-(2,4,6-trimethylphenyl)phenyl]-4-phenyl-2-pyridinyl]methylideneamino]naphthalen-1-ol;platinum?

8-[[6-[2-hydroxy-4-(2,4,6-trimethylphenyl)phenyl]-4-phenyl-2-pyridinyl]methylideneamino]naphthalen-1-ol;platinum has a molecular weight of 729.74 g/mol, XLogP of 9.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 8-[[6-[2-hydroxy-4-(2,4,6-trimethylphenyl)phenyl]-4-phenyl-2-pyridinyl]methylideneamino]naphthalen-1-ol;platinum is sourced from PubChem (CID 155609993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).