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

C44H54N6Pt — CID 162466983

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

1-[2,6-di(propan-2-yl)phenyl]-2-[5-[3-[5-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]pyrrol-1-id-2-yl]-2,3-dimethylbutan-2-yl]pyrrol-1-id-2-yl]imidazole;platinum(2+) (PubChem CID 162466983) has the molecular formula C44H54N6Pt and a molecular weight of 862.04 g/mol. Its IUPAC name is 1-[2,6-di(propan-2-yl)phenyl]-2-[5-[3-[5-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]pyrrol-1-id-2-yl]-2,3-dimethylbutan-2-yl]pyrrol-1-id-2-yl]imidazole;platinum(2+).

Molecular Properties

• Compound Name: 1-[2,6-di(propan-2-yl)phenyl]-2-[5-[3-[5-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]pyrrol-1-id-2-yl]-2,3-dimethylbutan-2-yl]pyrrol-1-id-2-yl]imidazole;platinum(2+)
• PubChem CID: 162466983
• Molecular Formula: C44H54N6Pt
• Molecular Weight: 862.04 g/mol
• Exact Mass: 861.41
• IUPAC Name: 1-[2,6-di(propan-2-yl)phenyl]-2-[5-[3-[5-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]pyrrol-1-id-2-yl]-2,3-dimethylbutan-2-yl]pyrrol-1-id-2-yl]imidazole;platinum(2+)
• SMILES: CC(C)c1cccc(C(C)C)c1-n1ccnc1-c1ccc(C(C)(C)C(C)(C)c2ccc(-c3nccn3-c3c(C(C)C)cccc3C(C)C)[n-]2)[n-]1.[Pt+2]
• InChI: InChI=1S/C44H54N6.Pt/c1-27(2)31-15-13-16-32(28(3)4)39(31)49-25-23-45-41(49)35-19-21-37(47-35)43(9,10)44(11,12)38-22-20-36(48-38)42-46-24-26-50(42)40-33(29(5)6)17-14-18-34(40)30(7)8;/h13-30H,1-12H3;/q-2;+2
• InChIKey: ICVPWMNXRJHNFC-UHFFFAOYSA-N
• XLogP: 11.05
• TPSA: 63.84 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 11
• Heavy Atoms: 51
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	862.04
LogP ≤ 5	11.05
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

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

The IUPAC name of 1-[2,6-di(propan-2-yl)phenyl]-2-[5-[3-[5-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]pyrrol-1-id-2-yl]-2,3-dimethylbutan-2-yl]pyrrol-1-id-2-yl]imidazole;platinum(2+) (CID 162466983) is 1-[2,6-di(propan-2-yl)phenyl]-2-[5-[3-[5-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]pyrrol-1-id-2-yl]-2,3-dimethylbutan-2-yl]pyrrol-1-id-2-yl]imidazole;platinum(2+).

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

The canonical SMILES for 1-[2,6-di(propan-2-yl)phenyl]-2-[5-[3-[5-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]pyrrol-1-id-2-yl]-2,3-dimethylbutan-2-yl]pyrrol-1-id-2-yl]imidazole;platinum(2+) is CC(C)c1cccc(C(C)C)c1-n1ccnc1-c1ccc(C(C)(C)C(C)(C)c2ccc(-c3nccn3-c3c(C(C)C)cccc3C(C)C)[n-]2)[n-]1.[Pt+2].

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

The InChIKey is ICVPWMNXRJHNFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H54N6.Pt/c1-27(2)31-15-13-16-32(28(3)4)39(31)49-25-23-45-41(49)35-19-21-37(47-35)43(9,10)44(11,12)38-22-20-36(48-38)42-46-24-26-50(42)40-33(29(5)6)17-14-18-34(40)30(7)8;/h13-30H,1-12H3;/q-2;+2.

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

1-[2,6-di(propan-2-yl)phenyl]-2-[5-[3-[5-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]pyrrol-1-id-2-yl]-2,3-dimethylbutan-2-yl]pyrrol-1-id-2-yl]imidazole;platinum(2+) has a molecular weight of 862.04 g/mol, XLogP of 11.05, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2,6-di(propan-2-yl)phenyl]-2-[5-[3-[5-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]pyrrol-1-id-2-yl]-2,3-dimethylbutan-2-yl]pyrrol-1-id-2-yl]imidazole;platinum(2+) is sourced from PubChem (CID 162466983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).