2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-5,6,7,8-tetrahydronaphthalen-1-ol;platinum

C54H50N3OPt- — CID 162783290

About 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-5,6,7,8-tetrahydronaphthalen-1-ol;platinum

2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-5,6,7,8-tetrahydronaphthalen-1-ol;platinum (PubChem CID 162783290) has the molecular formula C54H50N3OPt- and a molecular weight of 952.09 g/mol. Its IUPAC name is 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-5,6,7,8-tetrahydronaphthalen-1-ol;platinum.

Molecular Properties

• Compound Name: 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-5,6,7,8-tetrahydronaphthalen-1-ol;platinum
• PubChem CID: 162783290
• Molecular Formula: C54H50N3OPt-
• Molecular Weight: 952.09 g/mol
• Exact Mass: 951.36
• IUPAC Name: 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-5,6,7,8-tetrahydronaphthalen-1-ol;platinum
• SMILES: CC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2cccc3c2nc(-c2ccc4c(c2O)CCCC4)n3-c2ccc(C(C)(C)C)cc2-c2ccccc2)c1.[Pt]
• InChI: InChI=1S/C54H50N3O.Pt/c1-53(2,3)41-25-27-48(46(34-41)36-18-11-8-12-19-36)57-49-23-15-22-43(50(49)56-52(57)45-26-24-37-20-13-14-21-44(37)51(45)58)39-30-40(32-42(31-39)54(4,5)6)47-33-38(28-29-55-47)35-16-9-7-10-17-35;/h7-12,15-19,22-29,31-34,58H,13-14,20-21H2,1-6H3;/q-1
• InChIKey: YZRLSTZVTCRRSL-UHFFFAOYSA-N
• XLogP: 13.73
• TPSA: 50.94 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 59
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	952.09
LogP ≤ 5	13.73
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-5,6,7,8-tetrahydronaphthalen-1-ol;platinum?

The IUPAC name of 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-5,6,7,8-tetrahydronaphthalen-1-ol;platinum (CID 162783290) is 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-5,6,7,8-tetrahydronaphthalen-1-ol;platinum.

What is the SMILES notation for 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-5,6,7,8-tetrahydronaphthalen-1-ol;platinum?

The canonical SMILES for 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-5,6,7,8-tetrahydronaphthalen-1-ol;platinum is CC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2cccc3c2nc(-c2ccc4c(c2O)CCCC4)n3-c2ccc(C(C)(C)C)cc2-c2ccccc2)c1.[Pt].

What is the InChIKey of 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-5,6,7,8-tetrahydronaphthalen-1-ol;platinum?

The InChIKey is YZRLSTZVTCRRSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H50N3O.Pt/c1-53(2,3)41-25-27-48(46(34-41)36-18-11-8-12-19-36)57-49-23-15-22-43(50(49)56-52(57)45-26-24-37-20-13-14-21-44(37)51(45)58)39-30-40(32-42(31-39)54(4,5)6)47-33-38(28-29-55-47)35-16-9-7-10-17-35;/h7-12,15-19,22-29,31-34,58H,13-14,20-21H2,1-6H3;/q-1;.

What are the key properties of 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-5,6,7,8-tetrahydronaphthalen-1-ol;platinum?

2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-5,6,7,8-tetrahydronaphthalen-1-ol;platinum has a molecular weight of 952.09 g/mol, XLogP of 13.73, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]-5,6,7,8-tetrahydronaphthalen-1-ol;platinum is sourced from PubChem (CID 162783290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).