1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]benzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]imidazole;platinum(2+)

C43H46N4OPt — CID 140593519

About 1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]benzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]imidazole;platinum(2+)

1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]benzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]imidazole;platinum(2+) (PubChem CID 140593519) has the molecular formula C43H46N4OPt and a molecular weight of 829.95 g/mol. Its IUPAC name is 1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]benzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]imidazole;platinum(2+).

Molecular Properties

• Compound Name: 1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]benzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]imidazole;platinum(2+)
• PubChem CID: 140593519
• Molecular Formula: C43H46N4OPt
• Molecular Weight: 829.95 g/mol
• Exact Mass: 829.33
• IUPAC Name: 1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]benzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]imidazole;platinum(2+)
• SMILES: Cc1cc(Oc2[c-]c(-c3nccn3-c3c(C(C)C)cccc3C(C)C)ccc2)[c-]c(-c2nccn2-c2c(C(C)C)cccc2C(C)C)c1.[Pt+2]
• InChI: InChI=1S/C43H46N4O.Pt/c1-27(2)36-15-11-16-37(28(3)4)40(36)46-21-19-44-42(46)32-13-10-14-34(25-32)48-35-24-31(9)23-33(26-35)43-45-20-22-47(43)41-38(29(5)6)17-12-18-39(41)30(7)8;/h10-24,27-30H,1-9H3;/q-2;+2
• InChIKey: TUMCHZDOGCFPFK-UHFFFAOYSA-N
• XLogP: 11.58
• TPSA: 44.87 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 10
• Heavy Atoms: 49
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	829.95
LogP ≤ 5	11.58
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]benzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]imidazole;platinum(2+)?

The IUPAC name of 1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]benzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]imidazole;platinum(2+) (CID 140593519) is 1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]benzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]imidazole;platinum(2+).

What is the SMILES notation for 1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]benzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]imidazole;platinum(2+)?

The canonical SMILES for 1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]benzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]imidazole;platinum(2+) is Cc1cc(Oc2[c-]c(-c3nccn3-c3c(C(C)C)cccc3C(C)C)ccc2)[c-]c(-c2nccn2-c2c(C(C)C)cccc2C(C)C)c1.[Pt+2].

What is the InChIKey of 1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]benzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]imidazole;platinum(2+)?

The InChIKey is TUMCHZDOGCFPFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H46N4O.Pt/c1-27(2)36-15-11-16-37(28(3)4)40(36)46-21-19-44-42(46)32-13-10-14-34(25-32)48-35-24-31(9)23-33(26-35)43-45-20-22-47(43)41-38(29(5)6)17-12-18-39(41)30(7)8;/h10-24,27-30H,1-9H3;/q-2;+2.

What are the key properties of 1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]benzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]imidazole;platinum(2+)?

1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]benzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]imidazole;platinum(2+) has a molecular weight of 829.95 g/mol, XLogP of 11.58, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]benzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]imidazole;platinum(2+) is sourced from PubChem (CID 140593519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).