3-[2-[3-tert-butyl-5-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;3-[2-[3-tert-butyl-5-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;platinum

C176H136N20O4Pt4-12 — CID 163759205

About 3-[2-[3-tert-butyl-5-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;3-[2-[3-tert-butyl-5-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;platinum

3-[2-[3-tert-butyl-5-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;3-[2-[3-tert-butyl-5-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;platinum (PubChem CID 163759205) has the molecular formula C176H136N20O4Pt4-12 and a molecular weight of 3387.55 g/mol. Its IUPAC name is 3-[2-[3-tert-butyl-5-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;3-[2-[3-tert-butyl-5-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;platinum.

Molecular Properties

• Compound Name: 3-[2-[3-tert-butyl-5-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;3-[2-[3-tert-butyl-5-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;platinum
• PubChem CID: 163759205
• Molecular Formula: C176H136N20O4Pt4-12
• Molecular Weight: 3387.55 g/mol
• Exact Mass: 3385.05
• IUPAC Name: 3-[2-[3-tert-butyl-5-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;3-[2-[3-tert-butyl-5-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;platinum
• SMILES: [2H]C([2H])([2H])N1[CH-]N(c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc4c(cn3)c3ccc(C)cc3n4C)cc(C(C)(C)C)c2)c2cc(-c3ccccc3)ccc21.[2H]C([2H])([2H])N1[CH-]N(c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc4c(cn3)c3ccc(C)cc3n4C)cc(C(C)(C)C)c2)c2ccccc21.[2H]C([2H])([2H])N1[CH-]N(c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc4c(cn3)c3ccc(C)cc3n4C)ccc2)c2cc(-c3ccccc3)ccc21.[2H]C([2H])([2H])N1[CH-]N(c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc4c(cn3)c3ccc(C)cc3n4C)ccc2)c2ccccc21.[Pt].[Pt].[Pt].[Pt]
• InChI: InChI=1S/C49H40N5O.C45H32N5O.C43H36N5O.C39H28N5O.4Pt/c1-31-16-19-40-41-29-50-48(28-45(41)52(6)44(40)22-31)54-42-15-11-10-14-38(42)39-20-18-36(27-46(39)54)55-37-25-34(49(2,3)4)24-35(26-37)53-30-51(5)43-21-17-33(23-47(43)53)32-12-8-7-9-13-32;1-29-16-19-37-38-27-46-45(26-42(38)48(3)41(37)22-29)50-39-15-8-7-14-35(39)36-20-18-34(25-43(36)50)51-33-13-9-12-32(24-33)49-28-47(2)40-21-17-31(23-44(40)49)30-10-5-4-6-11-30;1-27-15-17-34-35-25-44-42(24-40(35)46(6)39(34)19-27)48-36-12-8-7-11-32(36)33-18-16-30(23-41(33)48)49-31-21-28(43(2,3)4)20-29(22-31)47-26-45(5)37-13-9-10-14-38(37)47;1-25-15-17-31-32-23-40-39(22-37(32)42(3)36(31)19-25)44-33-12-5-4-11-29(33)30-18-16-28(21-38(30)44)45-27-10-8-9-26(20-27)43-24-41(2)34-13-6-7-14-35(34)43;;;;/h7-25,28-30H,1-6H3;4-23,26-28H,1-3H3;7-21,24-26H,1-6H3;4-19,22-24H,1-3H3;;;;/q4*-3;;;;/i5D3;2D3;5D3;2D3
• InChIKey: IBOMJZGQMLYQCM-CYJFJHLZSA-N
• XLogP: 42.85
• TPSA: 153.84 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 22
• Heavy Atoms: 204
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3387.55
LogP ≤ 5	42.85
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-[2-[3-tert-butyl-5-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;3-[2-[3-tert-butyl-5-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;platinum?

The IUPAC name of 3-[2-[3-tert-butyl-5-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;3-[2-[3-tert-butyl-5-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;platinum (CID 163759205) is 3-[2-[3-tert-butyl-5-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;3-[2-[3-tert-butyl-5-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;platinum.

What is the SMILES notation for 3-[2-[3-tert-butyl-5-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;3-[2-[3-tert-butyl-5-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;platinum?

The canonical SMILES for 3-[2-[3-tert-butyl-5-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;3-[2-[3-tert-butyl-5-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;platinum is [2H]C([2H])([2H])N1[CH-]N(c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc4c(cn3)c3ccc(C)cc3n4C)cc(C(C)(C)C)c2)c2cc(-c3ccccc3)ccc21.[2H]C([2H])([2H])N1[CH-]N(c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc4c(cn3)c3ccc(C)cc3n4C)cc(C(C)(C)C)c2)c2ccccc21.[2H]C([2H])([2H])N1[CH-]N(c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc4c(cn3)c3ccc(C)cc3n4C)ccc2)c2cc(-c3ccccc3)ccc21.[2H]C([2H])([2H])N1[CH-]N(c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc4c(cn3)c3ccc(C)cc3n4C)ccc2)c2ccccc21.[Pt].[Pt].[Pt].[Pt].

What is the InChIKey of 3-[2-[3-tert-butyl-5-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;3-[2-[3-tert-butyl-5-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;platinum?

The InChIKey is IBOMJZGQMLYQCM-CYJFJHLZSA-N. The full InChI is InChI=1S/C49H40N5O.C45H32N5O.C43H36N5O.C39H28N5O.4Pt/c1-31-16-19-40-41-29-50-48(28-45(41)52(6)44(40)22-31)54-42-15-11-10-14-38(42)39-20-18-36(27-46(39)54)55-37-25-34(49(2,3)4)24-35(26-37)53-30-51(5)43-21-17-33(23-47(43)53)32-12-8-7-9-13-32;1-29-16-19-37-38-27-46-45(26-42(38)48(3)41(37)22-29)50-39-15-8-7-14-35(39)36-20-18-34(25-43(36)50)51-33-13-9-12-32(24-33)49-28-47(2)40-21-17-31(23-44(40)49)30-10-5-4-6-11-30;1-27-15-17-34-35-25-44-42(24-40(35)46(6)39(34)19-27)48-36-12-8-7-11-32(36)33-18-16-30(23-41(33)48)49-31-21-28(43(2,3)4)20-29(22-31)47-26-45(5)37-13-9-10-14-38(37)47;1-25-15-17-31-32-23-40-39(22-37(32)42(3)36(31)19-25)44-33-12-5-4-11-29(33)30-18-16-28(21-38(30)44)45-27-10-8-9-26(20-27)43-24-41(2)34-13-6-7-14-35(34)43;;;;/h7-25,28-30H,1-6H3;4-23,26-28H,1-3H3;7-21,24-26H,1-6H3;4-19,22-24H,1-3H3;;;;/q4*-3;;;;/i5D3;2D3;5D3;2D3;;;;.

What are the key properties of 3-[2-[3-tert-butyl-5-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;3-[2-[3-tert-butyl-5-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;platinum?

3-[2-[3-tert-butyl-5-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;3-[2-[3-tert-butyl-5-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;platinum has a molecular weight of 3387.55 g/mol, XLogP of 42.85, 22 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[2-[3-tert-butyl-5-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;3-[2-[3-tert-butyl-5-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]oxy-1H-carbazol-1-id-9-yl]-5,7-dimethylpyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[6-phenyl-3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;5,7-dimethyl-3-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyrido[4,3-b]indole;platinum is sourced from PubChem (CID 163759205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).