2-(1-methylbenzimidazol-2-yl)-9-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)

C34H23N5Pt — CID 153285067

About 2-(1-methylbenzimidazol-2-yl)-9-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)

2-(1-methylbenzimidazol-2-yl)-9-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+) (PubChem CID 153285067) has the molecular formula C34H23N5Pt and a molecular weight of 696.67 g/mol. Its IUPAC name is 2-(1-methylbenzimidazol-2-yl)-9-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+).

Molecular Properties

• Compound Name: 2-(1-methylbenzimidazol-2-yl)-9-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)
• PubChem CID: 153285067
• Molecular Formula: C34H23N5Pt
• Molecular Weight: 696.67 g/mol
• Exact Mass: 696.16
• IUPAC Name: 2-(1-methylbenzimidazol-2-yl)-9-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)
• SMILES: Cn1c(-c2[c-]c(-n3c4[c-]c(-c5nc6ccccc6n5C)ccc4c4ccccc43)ccc2)nc2ccccc21.[Pt+2]
• InChI: InChI=1S/C34H23N5.Pt/c1-37-30-16-7-4-13-27(30)35-33(37)22-10-9-11-24(20-22)39-29-15-6-3-12-25(29)26-19-18-23(21-32(26)39)34-36-28-14-5-8-17-31(28)38(34)2;/h3-19H,1-2H3;/q-2;+2
• InChIKey: AYODGSFFTAHRAS-UHFFFAOYSA-N
• XLogP: 7.49
• TPSA: 40.57 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 40
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	696.67
LogP ≤ 5	7.49
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 2-(1-methylbenzimidazol-2-yl)-9-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)?

The IUPAC name of 2-(1-methylbenzimidazol-2-yl)-9-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+) (CID 153285067) is 2-(1-methylbenzimidazol-2-yl)-9-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+).

What is the SMILES notation for 2-(1-methylbenzimidazol-2-yl)-9-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)?

The canonical SMILES for 2-(1-methylbenzimidazol-2-yl)-9-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+) is Cn1c(-c2[c-]c(-n3c4[c-]c(-c5nc6ccccc6n5C)ccc4c4ccccc43)ccc2)nc2ccccc21.[Pt+2].

What is the InChIKey of 2-(1-methylbenzimidazol-2-yl)-9-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)?

The InChIKey is AYODGSFFTAHRAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H23N5.Pt/c1-37-30-16-7-4-13-27(30)35-33(37)22-10-9-11-24(20-22)39-29-15-6-3-12-25(29)26-19-18-23(21-32(26)39)34-36-28-14-5-8-17-31(28)38(34)2;/h3-19H,1-2H3;/q-2;+2.

What are the key properties of 2-(1-methylbenzimidazol-2-yl)-9-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)?

2-(1-methylbenzimidazol-2-yl)-9-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+) has a molecular weight of 696.67 g/mol, XLogP of 7.49, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(1-methylbenzimidazol-2-yl)-9-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+) is sourced from PubChem (CID 153285067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).