2-[4-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-(2-phenyl-4-propan-2-ylphenyl)benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum

C61H58N3OPt- — CID 164701671

About 2-[4-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-(2-phenyl-4-propan-2-ylphenyl)benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum

2-[4-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-(2-phenyl-4-propan-2-ylphenyl)benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum (PubChem CID 164701671) has the molecular formula C61H58N3OPt- and a molecular weight of 1044.23 g/mol. Its IUPAC name is 2-[4-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-(2-phenyl-4-propan-2-ylphenyl)benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum.

Molecular Properties

• Compound Name: 2-[4-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-(2-phenyl-4-propan-2-ylphenyl)benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum
• PubChem CID: 164701671
• Molecular Formula: C61H58N3OPt-
• Molecular Weight: 1044.23 g/mol
• Exact Mass: 1043.42
• IUPAC Name: 2-[4-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-(2-phenyl-4-propan-2-ylphenyl)benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum
• SMILES: CC(C)c1ccc(-n2c(-c3cc(C(C)C)cc(C(C)C)c3O)nc3c(-c4[c-]c(-c5cc(-c6ccc(C(C)(C)C)cc6)ccn5)cc(-c5ccccc5)c4)cccc32)c(-c2ccccc2)c1.[Pt]
• InChI: InChI=1S/C61H58N3O.Pt/c1-38(2)44-25-28-56(53(34-44)43-19-14-11-15-20-43)64-57-22-16-21-51(58(57)63-60(64)54-36-46(39(3)4)35-52(40(5)6)59(54)65)48-31-47(41-17-12-10-13-18-41)32-49(33-48)55-37-45(29-30-62-55)42-23-26-50(27-24-42)61(7,8)9;/h10-32,34-40,65H,1-9H3;/q-1
• InChIKey: WCZWRTDZAYWIES-UHFFFAOYSA-N
• XLogP: 16.59
• TPSA: 50.94 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 10
• Heavy Atoms: 66
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1044.23
LogP ≤ 5	16.59
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-[4-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-(2-phenyl-4-propan-2-ylphenyl)benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum?

The IUPAC name of 2-[4-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-(2-phenyl-4-propan-2-ylphenyl)benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum (CID 164701671) is 2-[4-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-(2-phenyl-4-propan-2-ylphenyl)benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum.

What is the SMILES notation for 2-[4-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-(2-phenyl-4-propan-2-ylphenyl)benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum?

The canonical SMILES for 2-[4-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-(2-phenyl-4-propan-2-ylphenyl)benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum is CC(C)c1ccc(-n2c(-c3cc(C(C)C)cc(C(C)C)c3O)nc3c(-c4[c-]c(-c5cc(-c6ccc(C(C)(C)C)cc6)ccn5)cc(-c5ccccc5)c4)cccc32)c(-c2ccccc2)c1.[Pt].

What is the InChIKey of 2-[4-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-(2-phenyl-4-propan-2-ylphenyl)benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum?

The InChIKey is WCZWRTDZAYWIES-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H58N3O.Pt/c1-38(2)44-25-28-56(53(34-44)43-19-14-11-15-20-43)64-57-22-16-21-51(58(57)63-60(64)54-36-46(39(3)4)35-52(40(5)6)59(54)65)48-31-47(41-17-12-10-13-18-41)32-49(33-48)55-37-45(29-30-62-55)42-23-26-50(27-24-42)61(7,8)9;/h10-32,34-40,65H,1-9H3;/q-1;.

What are the key properties of 2-[4-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-(2-phenyl-4-propan-2-ylphenyl)benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum?

2-[4-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-(2-phenyl-4-propan-2-ylphenyl)benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum has a molecular weight of 1044.23 g/mol, XLogP of 16.59, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-(2-phenyl-4-propan-2-ylphenyl)benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum is sourced from PubChem (CID 164701671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).