7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+))

C186H168F8N20Pt4+8 — CID 158620583

IUPAC7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+))
SMILES[2H]C([2H])([2H])C(c1ccc([N+]2=C=[N+](c3[c-]c(C(F)(F)c4[c-]c5c(cc4)c4ncccc4n5-c4cc(C(C)(C)C)ccn4)cc(C(C)(C)C)c3)c3ccccc32)cc1)(C([2H])([2H])[2H])C([2H])([2H])[2H].[2H]c1c([2H])c(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])c([2H])c([2H])c1[N+]1=C=[N+](c2[c-]c(C(F)(F)c3[c-]c4c(cc3)c3ncccc3n4-c3cc(C(C)(C)C)ccn3)cc(C(C)(C)C)c2)c2ccccc21.[2H]c1c([2H])c(C([2H])([2H])[2H])c([2H])c([2H])c1[N+]1=C=[N+](c2[c-]c(C(F)(F)c3[c-]c4c(cc3)c3ncccc3n4-c3cc(C(C)(C)C)ccn3)cc(C(C)(C)C)c2)c2ccccc21.[2H]c1c([2H])c([2H])c2c(c1[2H])[N+](c1[c-]c(C(F)(F)c3[c-]c4c(cc3)c3ncccc3n4-c3cc(C(C)(C)C)ccn3)cc(C(C)(C)C)c1)=C=[N+]2c1ccc(C([2H])([2H])[2H])cc1.[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/2C48H45F2N5.2C45H39F2N5.4Pt/c2*1-45(2,3)31-16-19-36(20-17-31)53-30-54(40-14-11-10-13-39(40)53)37-26-34(47(7,8)9)25-35(27-37)48(49,50)33-18-21-38-42(28-33)55(41-15-12-23-52-44(38)41)43-29-32(22-24-51-43)46(4,5)6;2*1-29-14-17-34(18-15-29)50-28-51(38-12-9-8-11-37(38)50)35-24-32(44(5,6)7)23-33(25-35)45(46,47)31-16-19-36-40(26-31)52(39-13-10-21-49-42(36)39)41-27-30(20-22-48-41)43(2,3)4;;;;/h2*10-26,29H,1-9H3;2*8-24,27H,1-7H3;;;;/q;;;;4*+2/i1D3,2D3,3D3,16D,17D,19D,20D;1D3,2D3,3D3;1D3,14D,15D,17D,18D;1D3,8D,9D,11D,12D;;;;
InChIKeyBQMCGWIMCCBBCX-BMVRHHKMSA-N
MW3652.05 g/mol
LogP46.27
Rot. Bonds22

About 7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+))

7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+)) (PubChem CID 158620583) has the molecular formula C186H168F8N20Pt4+8 and a molecular weight of 3652.05 g/mol. Its IUPAC name is 7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+)).

Molecular Properties

Compound Name7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+))
PubChem CID158620583
Molecular FormulaC186H168F8N20Pt4+8
Molecular Weight3652.05 g/mol
Exact Mass3649.44
IUPAC Name7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+))
SMILES[2H]C([2H])([2H])C(c1ccc([N+]2=C=[N+](c3[c-]c(C(F)(F)c4[c-]c5c(cc4)c4ncccc4n5-c4cc(C(C)(C)C)ccn4)cc(C(C)(C)C)c3)c3ccccc32)cc1)(C([2H])([2H])[2H])C([2H])([2H])[2H].[2H]c1c([2H])c(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])c([2H])c([2H])c1[N+]1=C=[N+](c2[c-]c(C(F)(F)c3[c-]c4c(cc3)c3ncccc3n4-c3cc(C(C)(C)C)ccn3)cc(C(C)(C)C)c2)c2ccccc21.[2H]c1c([2H])c(C([2H])([2H])[2H])c([2H])c([2H])c1[N+]1=C=[N+](c2[c-]c(C(F)(F)c3[c-]c4c(cc3)c3ncccc3n4-c3cc(C(C)(C)C)ccn3)cc(C(C)(C)C)c2)c2ccccc21.[2H]c1c([2H])c([2H])c2c(c1[2H])[N+](c1[c-]c(C(F)(F)c3[c-]c4c(cc3)c3ncccc3n4-c3cc(C(C)(C)C)ccn3)cc(C(C)(C)C)c1)=C=[N+]2c1ccc(C([2H])([2H])[2H])cc1.[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/2C48H45F2N5.2C45H39F2N5.4Pt/c2*1-45(2,3)31-16-19-36(20-17-31)53-30-54(40-14-11-10-13-39(40)53)37-26-34(47(7,8)9)25-35(27-37)48(49,50)33-18-21-38-42(28-33)55(41-15-12-23-52-44(38)41)43-29-32(22-24-51-43)46(4,5)6;2*1-29-14-17-34(18-15-29)50-28-51(38-12-9-8-11-37(38)50)35-24-32(44(5,6)7)23-33(25-35)45(46,47)31-16-19-36-40(26-31)52(39-13-10-21-49-42(36)39)41-27-30(20-22-48-41)43(2,3)4;;;;/h2*10-26,29H,1-9H3;2*8-24,27H,1-7H3;;;;/q;;;;4*+2/i1D3,2D3,3D3,16D,17D,19D,20D;1D3,2D3,3D3;1D3,14D,15D,17D,18D;1D3,8D,9D,11D,12D;;;;
InChIKeyBQMCGWIMCCBBCX-BMVRHHKMSA-N
XLogP46.27
TPSA146.92 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds22
Heavy Atoms218
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003652.05
LogP ≤ 546.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+)) with MolForge

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Launch Full Analysis

Related Compounds

5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;platinum(2+)
CID 162465698
5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;platinum(2+)
CID 162465715
CID 158609914
CID 158609914
5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[4,3-b]indol-6-ide;platinum(2+)
CID 162465798
3-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[4,3-b]indol-4-ide;platinum(2+)
CID 162465634
7-[[3-tert-butyl-5-[3-(2-tert-butylphenyl)-4,5,6,7-tetradeuteriobenzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-9-(4-tert-butyl-2-pyridinyl)-8H-pyrido[3,4-b]indol-8-ide;platinum(2+)
CID 162465666
7-[3-[3-[2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;platinum(2+)
CID 162465819
5-(4-tert-butyl-2-pyridinyl)-3-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-(2,6-ditert-butylphenyl)benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-4H-pyrido[3,2-b]indol-4-ide;platinum(2+)
CID 162465652
7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]phenyl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)pyrido[3,2-b]indole
CID 158609920
3-[[3-tert-butyl-5-[3-(2-tert-butylphenyl)-4,5,6,7-tetradeuteriobenzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[4,3-b]indol-4-ide;platinum(2+)
CID 162465618
5-(4-tert-butyl-2-pyridinyl)-7-[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-(2,6-ditert-butylphenyl)benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-6H-pyrido[3,2-b]indol-6-ide;platinum(2+)
CID 162465833
7-[[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[4,3-b]indol-6-ide;platinum(2+)
CID 162465712

Frequently Asked Questions

What is the IUPAC name of 7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+))?
The IUPAC name of 7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+)) (CID 158620583) is 7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+)).
What is the SMILES notation for 7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+))?
The canonical SMILES for 7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+)) is [2H]C([2H])([2H])C(c1ccc([N+]2=C=[N+](c3[c-]c(C(F)(F)c4[c-]c5c(cc4)c4ncccc4n5-c4cc(C(C)(C)C)ccn4)cc(C(C)(C)C)c3)c3ccccc32)cc1)(C([2H])([2H])[2H])C([2H])([2H])[2H].[2H]c1c([2H])c(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])c([2H])c([2H])c1[N+]1=C=[N+](c2[c-]c(C(F)(F)c3[c-]c4c(cc3)c3ncccc3n4-c3cc(C(C)(C)C)ccn3)cc(C(C)(C)C)c2)c2ccccc21.[2H]c1c([2H])c(C([2H])([2H])[2H])c([2H])c([2H])c1[N+]1=C=[N+](c2[c-]c(C(F)(F)c3[c-]c4c(cc3)c3ncccc3n4-c3cc(C(C)(C)C)ccn3)cc(C(C)(C)C)c2)c2ccccc21.[2H]c1c([2H])c([2H])c2c(c1[2H])[N+](c1[c-]c(C(F)(F)c3[c-]c4c(cc3)c3ncccc3n4-c3cc(C(C)(C)C)ccn3)cc(C(C)(C)C)c1)=C=[N+]2c1ccc(C([2H])([2H])[2H])cc1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of 7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+))?
The InChIKey is BQMCGWIMCCBBCX-BMVRHHKMSA-N. The full InChI is InChI=1S/2C48H45F2N5.2C45H39F2N5.4Pt/c2*1-45(2,3)31-16-19-36(20-17-31)53-30-54(40-14-11-10-13-39(40)53)37-26-34(47(7,8)9)25-35(27-37)48(49,50)33-18-21-38-42(28-33)55(41-15-12-23-52-44(38)41)43-29-32(22-24-51-43)46(4,5)6;2*1-29-14-17-34(18-15-29)50-28-51(38-12-9-8-11-37(38)50)35-24-32(44(5,6)7)23-33(25-35)45(46,47)31-16-19-36-40(26-31)52(39-13-10-21-49-42(36)39)41-27-30(20-22-48-41)43(2,3)4;;;;/h2*10-26,29H,1-9H3;2*8-24,27H,1-7H3;;;;/q;;;;4*+2/i1D3,2D3,3D3,16D,17D,19D,20D;1D3,2D3,3D3;1D3,14D,15D,17D,18D;1D3,8D,9D,11D,12D;;;;.
What are the key properties of 7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+))?
7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+)) has a molecular weight of 3652.05 g/mol, XLogP of 46.27, 22 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[[3-tert-butyl-5-[3-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-5-(4-tert-butyl-2-pyridinyl)-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;5-(4-tert-butyl-2-pyridinyl)-7-[[3-tert-butyl-5-[4,5,6,7-tetradeuterio-3-[4-(trideuteriomethyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]-difluoromethyl]-6H-pyrido[3,2-b]indol-6-ide;tetrakis(platinum(2+)) is sourced from PubChem (CID 158620583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).