9-(4-tert-butyl-2-pyridinyl)-6-carbazol-9-yl-2-[3-[3-(9,9-dimethyl-3-phenylfluoren-4-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum

C67H50N5OPt-3 — CID 169065939

About 9-(4-tert-butyl-2-pyridinyl)-6-carbazol-9-yl-2-[3-[3-(9,9-dimethyl-3-phenylfluoren-4-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum

9-(4-tert-butyl-2-pyridinyl)-6-carbazol-9-yl-2-[3-[3-(9,9-dimethyl-3-phenylfluoren-4-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (PubChem CID 169065939) has the molecular formula C67H50N5OPt-3 and a molecular weight of 1136.25 g/mol. Its IUPAC name is 9-(4-tert-butyl-2-pyridinyl)-6-carbazol-9-yl-2-[3-[3-(9,9-dimethyl-3-phenylfluoren-4-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 9-(4-tert-butyl-2-pyridinyl)-6-carbazol-9-yl-2-[3-[3-(9,9-dimethyl-3-phenylfluoren-4-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• PubChem CID: 169065939
• Molecular Formula: C67H50N5OPt-3
• Molecular Weight: 1136.25 g/mol
• Exact Mass: 1135.37
• IUPAC Name: 9-(4-tert-butyl-2-pyridinyl)-6-carbazol-9-yl-2-[3-[3-(9,9-dimethyl-3-phenylfluoren-4-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(N5[CH-]N(c6c(-c7ccccc7)ccc7c6-c6ccccc6C7(C)C)c6ccccc65)ccc4)ccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.[Pt]
• InChI: InChI=1S/C67H50N5O.Pt/c1-66(2,3)44-36-37-68-63(38-44)72-59-35-30-46(71-57-26-13-10-22-50(57)51-23-11-14-27-58(51)71)40-54(59)52-32-31-48(41-62(52)72)73-47-21-17-20-45(39-47)69-42-70(61-29-16-15-28-60(61)69)65-49(43-18-7-6-8-19-43)33-34-56-64(65)53-24-9-12-25-55(53)67(56,4)5;/h6-38,40,42H,1-5H3;/q-3
• InChIKey: MXDHRYWDPZMFMB-UHFFFAOYSA-N
• XLogP: 17.35
• TPSA: 38.46 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 74
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1136.25
LogP ≤ 5	17.35
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 9-(4-tert-butyl-2-pyridinyl)-6-carbazol-9-yl-2-[3-[3-(9,9-dimethyl-3-phenylfluoren-4-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

The IUPAC name of 9-(4-tert-butyl-2-pyridinyl)-6-carbazol-9-yl-2-[3-[3-(9,9-dimethyl-3-phenylfluoren-4-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (CID 169065939) is 9-(4-tert-butyl-2-pyridinyl)-6-carbazol-9-yl-2-[3-[3-(9,9-dimethyl-3-phenylfluoren-4-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.

What is the SMILES notation for 9-(4-tert-butyl-2-pyridinyl)-6-carbazol-9-yl-2-[3-[3-(9,9-dimethyl-3-phenylfluoren-4-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

The canonical SMILES for 9-(4-tert-butyl-2-pyridinyl)-6-carbazol-9-yl-2-[3-[3-(9,9-dimethyl-3-phenylfluoren-4-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is CC(C)(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(N5[CH-]N(c6c(-c7ccccc7)ccc7c6-c6ccccc6C7(C)C)c6ccccc65)ccc4)ccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.[Pt].

What is the InChIKey of 9-(4-tert-butyl-2-pyridinyl)-6-carbazol-9-yl-2-[3-[3-(9,9-dimethyl-3-phenylfluoren-4-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

The InChIKey is MXDHRYWDPZMFMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H50N5O.Pt/c1-66(2,3)44-36-37-68-63(38-44)72-59-35-30-46(71-57-26-13-10-22-50(57)51-23-11-14-27-58(51)71)40-54(59)52-32-31-48(41-62(52)72)73-47-21-17-20-45(39-47)69-42-70(61-29-16-15-28-60(61)69)65-49(43-18-7-6-8-19-43)33-34-56-64(65)53-24-9-12-25-55(53)67(56,4)5;/h6-38,40,42H,1-5H3;/q-3;.

What are the key properties of 9-(4-tert-butyl-2-pyridinyl)-6-carbazol-9-yl-2-[3-[3-(9,9-dimethyl-3-phenylfluoren-4-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

9-(4-tert-butyl-2-pyridinyl)-6-carbazol-9-yl-2-[3-[3-(9,9-dimethyl-3-phenylfluoren-4-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum has a molecular weight of 1136.25 g/mol, XLogP of 17.35, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(4-tert-butyl-2-pyridinyl)-6-carbazol-9-yl-2-[3-[3-(9,9-dimethyl-3-phenylfluoren-4-yl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 169065939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).