1,5-dimethyl-3-[3-[3-(3,4,4-trimethyl-2H-quinazolin-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-pyrrolo[2,3-f]benzimidazol-2-ide;platinum(4+)

C34H31N5OPt — CID 164705316

About 1,5-dimethyl-3-[3-[3-(3,4,4-trimethyl-2H-quinazolin-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-pyrrolo[2,3-f]benzimidazol-2-ide;platinum(4+)

1,5-dimethyl-3-[3-[3-(3,4,4-trimethyl-2H-quinazolin-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-pyrrolo[2,3-f]benzimidazol-2-ide;platinum(4+) (PubChem CID 164705316) has the molecular formula C34H31N5OPt and a molecular weight of 720.73 g/mol. Its IUPAC name is 1,5-dimethyl-3-[3-[3-(3,4,4-trimethyl-2H-quinazolin-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-pyrrolo[2,3-f]benzimidazol-2-ide;platinum(4+).

Molecular Properties

• Compound Name: 1,5-dimethyl-3-[3-[3-(3,4,4-trimethyl-2H-quinazolin-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-pyrrolo[2,3-f]benzimidazol-2-ide;platinum(4+)
• PubChem CID: 164705316
• Molecular Formula: C34H31N5OPt
• Molecular Weight: 720.73 g/mol
• Exact Mass: 720.22
• IUPAC Name: 1,5-dimethyl-3-[3-[3-(3,4,4-trimethyl-2H-quinazolin-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-pyrrolo[2,3-f]benzimidazol-2-ide;platinum(4+)
• SMILES: CN1[CH-]N(c2[c-]c(Oc3[c-]c(N4[CH-]N(C)C(C)(C)c5ccccc54)ccc3)ccc2)c2cc3c(ccn3C)cc21.[Pt+4]
• InChI: InChI=1S/C34H31N5O.Pt/c1-34(2)29-14-6-7-15-30(29)39(23-37(34)5)26-11-9-13-28(20-26)40-27-12-8-10-25(19-27)38-22-36(4)32-18-24-16-17-35(3)31(24)21-33(32)38;/h6-18,21-23H,1-5H3;/q-4;+4
• InChIKey: HMRMKSIGFGJUKP-UHFFFAOYSA-N
• XLogP: 7.71
• TPSA: 27.12 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 41
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	720.73
LogP ≤ 5	7.71
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-3-[3-[3-(3,4,4-trimethyl-2H-quinazolin-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-pyrrolo[2,3-f]benzimidazol-2-ide;platinum(4+)?

The IUPAC name of 1,5-dimethyl-3-[3-[3-(3,4,4-trimethyl-2H-quinazolin-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-pyrrolo[2,3-f]benzimidazol-2-ide;platinum(4+) (CID 164705316) is 1,5-dimethyl-3-[3-[3-(3,4,4-trimethyl-2H-quinazolin-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-pyrrolo[2,3-f]benzimidazol-2-ide;platinum(4+).

What is the SMILES notation for 1,5-dimethyl-3-[3-[3-(3,4,4-trimethyl-2H-quinazolin-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-pyrrolo[2,3-f]benzimidazol-2-ide;platinum(4+)?

The canonical SMILES for 1,5-dimethyl-3-[3-[3-(3,4,4-trimethyl-2H-quinazolin-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-pyrrolo[2,3-f]benzimidazol-2-ide;platinum(4+) is CN1[CH-]N(c2[c-]c(Oc3[c-]c(N4[CH-]N(C)C(C)(C)c5ccccc54)ccc3)ccc2)c2cc3c(ccn3C)cc21.[Pt+4].

What is the InChIKey of 1,5-dimethyl-3-[3-[3-(3,4,4-trimethyl-2H-quinazolin-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-pyrrolo[2,3-f]benzimidazol-2-ide;platinum(4+)?

The InChIKey is HMRMKSIGFGJUKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H31N5O.Pt/c1-34(2)29-14-6-7-15-30(29)39(23-37(34)5)26-11-9-13-28(20-26)40-27-12-8-10-25(19-27)38-22-36(4)32-18-24-16-17-35(3)31(24)21-33(32)38;/h6-18,21-23H,1-5H3;/q-4;+4.

What are the key properties of 1,5-dimethyl-3-[3-[3-(3,4,4-trimethyl-2H-quinazolin-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-pyrrolo[2,3-f]benzimidazol-2-ide;platinum(4+)?

1,5-dimethyl-3-[3-[3-(3,4,4-trimethyl-2H-quinazolin-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-pyrrolo[2,3-f]benzimidazol-2-ide;platinum(4+) has a molecular weight of 720.73 g/mol, XLogP of 7.71, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 1,5-dimethyl-3-[3-[3-(3,4,4-trimethyl-2H-quinazolin-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-pyrrolo[2,3-f]benzimidazol-2-ide;platinum(4+) is sourced from PubChem (CID 164705316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).