7-tert-butyl-2-[3-tert-butyl-5-[5-tert-butyl-3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum

C56H63N4OPt-3 — CID 155650974

About 7-tert-butyl-2-[3-tert-butyl-5-[5-tert-butyl-3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum

7-tert-butyl-2-[3-tert-butyl-5-[5-tert-butyl-3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (PubChem CID 155650974) has the molecular formula C56H63N4OPt-3 and a molecular weight of 1003.22 g/mol. Its IUPAC name is 7-tert-butyl-2-[3-tert-butyl-5-[5-tert-butyl-3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 7-tert-butyl-2-[3-tert-butyl-5-[5-tert-butyl-3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• PubChem CID: 155650974
• Molecular Formula: C56H63N4OPt-3
• Molecular Weight: 1003.22 g/mol
• Exact Mass: 1002.47
• IUPAC Name: 7-tert-butyl-2-[3-tert-butyl-5-[5-tert-butyl-3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2ccc(C(C)(C)C)cc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(N2[CH-]N(c3cccc(C(C)(C)C)c3)c3cc(C(C)(C)C)ccc32)c1.[Pt]
• InChI: InChI=1S/C56H63N4O.Pt/c1-52(2,3)36-17-16-18-41(27-36)58-35-59(47-24-20-38(31-50(47)58)54(7,8)9)42-28-40(56(13,14)15)29-44(33-42)61-43-21-23-46-45-22-19-37(53(4,5)6)30-48(45)60(49(46)34-43)51-32-39(25-26-57-51)55(10,11)12;/h16-32,35H,1-15H3;/q-3
• InChIKey: WCXFUANZDGLDGW-UHFFFAOYSA-N
• XLogP: 15.47
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 62
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1003.22
LogP ≤ 5	15.47
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 7-tert-butyl-2-[3-tert-butyl-5-[5-tert-butyl-3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

The IUPAC name of 7-tert-butyl-2-[3-tert-butyl-5-[5-tert-butyl-3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (CID 155650974) is 7-tert-butyl-2-[3-tert-butyl-5-[5-tert-butyl-3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum.

What is the SMILES notation for 7-tert-butyl-2-[3-tert-butyl-5-[5-tert-butyl-3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

The canonical SMILES for 7-tert-butyl-2-[3-tert-butyl-5-[5-tert-butyl-3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is CC(C)(C)c1cc(Oc2[c-]c3c(cc2)c2ccc(C(C)(C)C)cc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(N2[CH-]N(c3cccc(C(C)(C)C)c3)c3cc(C(C)(C)C)ccc32)c1.[Pt].

What is the InChIKey of 7-tert-butyl-2-[3-tert-butyl-5-[5-tert-butyl-3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

The InChIKey is WCXFUANZDGLDGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H63N4O.Pt/c1-52(2,3)36-17-16-18-41(27-36)58-35-59(47-24-20-38(31-50(47)58)54(7,8)9)42-28-40(56(13,14)15)29-44(33-42)61-43-21-23-46-45-22-19-37(53(4,5)6)30-48(45)60(49(46)34-43)51-32-39(25-26-57-51)55(10,11)12;/h16-32,35H,1-15H3;/q-3;.

What are the key properties of 7-tert-butyl-2-[3-tert-butyl-5-[5-tert-butyl-3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

7-tert-butyl-2-[3-tert-butyl-5-[5-tert-butyl-3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum has a molecular weight of 1003.22 g/mol, XLogP of 15.47, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 7-tert-butyl-2-[3-tert-butyl-5-[5-tert-butyl-3-(3-tert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 155650974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).