2,6-dimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-10-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-9H-[1]benzofuro[2,3-c][1,5]naphthyridin-9-ide;platinum(2+)

C72H62N6O2Pt — CID 176823345

About 2,6-dimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-10-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-9H-[1]benzofuro[2,3-c][1,5]naphthyridin-9-ide;platinum(2+)

2,6-dimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-10-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-9H-[1]benzofuro[2,3-c][1,5]naphthyridin-9-ide;platinum(2+) (PubChem CID 176823345) has the molecular formula C72H62N6O2Pt and a molecular weight of 1238.41 g/mol. Its IUPAC name is 2,6-dimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-10-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-9H-[1]benzofuro[2,3-c][1,5]naphthyridin-9-ide;platinum(2+).

Molecular Properties

• Compound Name: 2,6-dimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-10-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-9H-[1]benzofuro[2,3-c][1,5]naphthyridin-9-ide;platinum(2+)
• PubChem CID: 176823345
• Molecular Formula: C72H62N6O2Pt
• Molecular Weight: 1238.41 g/mol
• Exact Mass: 1237.46
• IUPAC Name: 2,6-dimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-10-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-9H-[1]benzofuro[2,3-c][1,5]naphthyridin-9-ide;platinum(2+)
• SMILES: Cc1ccc2nc(C)c3oc4c(-c5nc6ccccc6n5-c5c(C(C)C)cc(-c6ccccc6)cc5C(C)C)[c-]c(Oc5[c-]c(-c6nc7ccccc7n6-c6c(C(C)C)cc(-c7ccccc7)cc6C(C)C)ccc5)cc4c3c2n1.[Pt+2]
• InChI: InChI=1S/C72H62N6O2.Pt/c1-41(2)54-35-50(47-22-13-11-14-23-47)36-55(42(3)4)67(54)77-63-30-19-17-28-60(63)75-71(77)49-26-21-27-52(34-49)79-53-39-58-65-66-62(33-32-45(9)73-66)74-46(10)69(65)80-70(58)59(40-53)72-76-61-29-18-20-31-64(61)78(72)68-56(43(5)6)37-51(38-57(68)44(7)8)48-24-15-12-16-25-48;/h11-33,35-39,41-44H,1-10H3;/q-2;+2
• InChIKey: AFQDBQWRUNLJFA-UHFFFAOYSA-N
• XLogP: 19.38
• TPSA: 83.79 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 12
• Heavy Atoms: 81
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1238.41
LogP ≤ 5	19.38
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-10-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-9H-[1]benzofuro[2,3-c][1,5]naphthyridin-9-ide;platinum(2+)?

The IUPAC name of 2,6-dimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-10-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-9H-[1]benzofuro[2,3-c][1,5]naphthyridin-9-ide;platinum(2+) (CID 176823345) is 2,6-dimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-10-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-9H-[1]benzofuro[2,3-c][1,5]naphthyridin-9-ide;platinum(2+).

What is the SMILES notation for 2,6-dimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-10-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-9H-[1]benzofuro[2,3-c][1,5]naphthyridin-9-ide;platinum(2+)?

The canonical SMILES for 2,6-dimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-10-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-9H-[1]benzofuro[2,3-c][1,5]naphthyridin-9-ide;platinum(2+) is Cc1ccc2nc(C)c3oc4c(-c5nc6ccccc6n5-c5c(C(C)C)cc(-c6ccccc6)cc5C(C)C)[c-]c(Oc5[c-]c(-c6nc7ccccc7n6-c6c(C(C)C)cc(-c7ccccc7)cc6C(C)C)ccc5)cc4c3c2n1.[Pt+2].

What is the InChIKey of 2,6-dimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-10-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-9H-[1]benzofuro[2,3-c][1,5]naphthyridin-9-ide;platinum(2+)?

The InChIKey is AFQDBQWRUNLJFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H62N6O2.Pt/c1-41(2)54-35-50(47-22-13-11-14-23-47)36-55(42(3)4)67(54)77-63-30-19-17-28-60(63)75-71(77)49-26-21-27-52(34-49)79-53-39-58-65-66-62(33-32-45(9)73-66)74-46(10)69(65)80-70(58)59(40-53)72-76-61-29-18-20-31-64(61)78(72)68-56(43(5)6)37-51(38-57(68)44(7)8)48-24-15-12-16-25-48;/h11-33,35-39,41-44H,1-10H3;/q-2;+2.

What are the key properties of 2,6-dimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-10-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-9H-[1]benzofuro[2,3-c][1,5]naphthyridin-9-ide;platinum(2+)?

2,6-dimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-10-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-9H-[1]benzofuro[2,3-c][1,5]naphthyridin-9-ide;platinum(2+) has a molecular weight of 1238.41 g/mol, XLogP of 19.38, 12 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 2,6-dimethyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-10-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-9H-[1]benzofuro[2,3-c][1,5]naphthyridin-9-ide;platinum(2+) is sourced from PubChem (CID 176823345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).