3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+))

C275H240N24O5Pt5+10 — CID 158576507

IUPAC3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+))
SMILES[2H]c1c([2H])c(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c([N+]2=C=[N+](c3[c-]c(Oc4[c-]c5c(nc4)c4ccccc4n5-c4cc(C(C)(C)C)ccn4)cc(C(C)(C)C)c3)c3ccccc32)c(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[2H]c1c([2H])c(C([2H])([2H])[2H])c([2H])c([2H])c1-c1cccc(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c1[N+]1=C=[N+](c2[c-]c(Oc3[c-]c4c(nc3)c3ccccc3n4-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-c1cccc(C(C)(C)C)c1[N+]1=C=[N+](c2[c-]c(Oc3[c-]c4c(nc3)c3ccccc3n4-c3cc(C(C)(C)C)ccn3)cc(C(C)(C)C)c2)c2ccccc21.[2H]c1c([2H])c([2H])c(-c2c([2H])c([2H])c([2H])c(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2[N+]2=C=[N+](c3[c-]c(Oc4[c-]c5c(nc4)c4ccccc4n5-c4cc(C(C)(C)C)ccn4)cc(C(C)(C)C)c3)c3ccccc32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c2c(c1[2H])c1ccc(Oc3[c-]c([N+]4=C=[N+](c5ccccc5-c5c(C([2H])([2H])[2H])cccc5C([2H])([2H])[2H])c5ccccc54)cc(C(C)(C)C)c3)[c-]c1n2-c1cc(C(C)(C)C)ccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/2C57H49N5O.C55H45N5O.C54H51N5O.C52H46N4O.5Pt/c2*1-37-20-24-39(25-21-37)46-15-13-16-47(40-26-22-38(2)23-27-40)55(46)61-36-60(50-18-11-12-19-51(50)61)43-30-42(57(6,7)8)31-44(33-43)63-45-34-52-54(59-35-45)48-14-9-10-17-49(48)62(52)53-32-41(28-29-58-53)56(3,4)5;1-54(2,3)39-28-29-56-51(32-39)60-47-25-14-13-22-46(47)52-50(60)34-43(35-57-52)61-42-31-40(55(4,5)6)30-41(33-42)58-36-59(49-27-16-15-26-48(49)58)53-44(37-18-9-7-10-19-37)23-17-24-45(53)38-20-11-8-12-21-38;1-35-22-24-36(25-23-35)42-17-15-18-44(54(8,9)10)51(42)58-34-57(46-20-13-14-21-47(46)58)39-28-38(53(5,6)7)29-40(31-39)60-41-32-48-50(56-33-41)43-16-11-12-19-45(43)59(48)49-30-37(26-27-55-49)52(2,3)4;1-34-16-15-17-35(2)50(34)43-19-10-11-20-44(43)55-33-54(46-22-13-14-23-47(46)55)38-28-37(52(6,7)8)29-40(31-38)57-39-24-25-42-41-18-9-12-21-45(41)56(48(42)32-39)49-30-36(26-27-53-49)51(3,4)5;;;;;/h2*9-32,35H,1-8H3;7-32,35H,1-6H3;11-30,33H,1-10H3;9-30H,1-8H3;;;;;/q;;;;;5*+2/i1D3,2D3,13D,15D,16D,20D,21D,22D,23D,24D,25D,26D,27D;1D3,2D3,20D,21D,22D,23D,24D,25D,26D,27D;7D,8D,9D,10D,11D,12D,17D,18D,19D,20D,21D,23D,24D;1D3,22D,23D,24D,25D;1D3,2D3,9D,12D,18D,21D;;;;;
InChIKeyRITLSEHKCOSIEE-DXRSUUNZSA-N
MW4997.87 g/mol
LogP69.48
Rot. Bonds40

About 3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+))

3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+)) (PubChem CID 158576507) has the molecular formula C275H240N24O5Pt5+10 and a molecular weight of 4997.87 g/mol. Its IUPAC name is 3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+)).

Molecular Properties

Compound Name3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+))
PubChem CID158576507
Molecular FormulaC275H240N24O5Pt5+10
Molecular Weight4997.87 g/mol
Exact Mass4994.13
IUPAC Name3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+))
SMILES[2H]c1c([2H])c(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c([N+]2=C=[N+](c3[c-]c(Oc4[c-]c5c(nc4)c4ccccc4n5-c4cc(C(C)(C)C)ccn4)cc(C(C)(C)C)c3)c3ccccc32)c(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[2H]c1c([2H])c(C([2H])([2H])[2H])c([2H])c([2H])c1-c1cccc(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c1[N+]1=C=[N+](c2[c-]c(Oc3[c-]c4c(nc3)c3ccccc3n4-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-c1cccc(C(C)(C)C)c1[N+]1=C=[N+](c2[c-]c(Oc3[c-]c4c(nc3)c3ccccc3n4-c3cc(C(C)(C)C)ccn3)cc(C(C)(C)C)c2)c2ccccc21.[2H]c1c([2H])c([2H])c(-c2c([2H])c([2H])c([2H])c(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2[N+]2=C=[N+](c3[c-]c(Oc4[c-]c5c(nc4)c4ccccc4n5-c4cc(C(C)(C)C)ccn4)cc(C(C)(C)C)c3)c3ccccc32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c2c(c1[2H])c1ccc(Oc3[c-]c([N+]4=C=[N+](c5ccccc5-c5c(C([2H])([2H])[2H])cccc5C([2H])([2H])[2H])c5ccccc54)cc(C(C)(C)C)c3)[c-]c1n2-c1cc(C(C)(C)C)ccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/2C57H49N5O.C55H45N5O.C54H51N5O.C52H46N4O.5Pt/c2*1-37-20-24-39(25-21-37)46-15-13-16-47(40-26-22-38(2)23-27-40)55(46)61-36-60(50-18-11-12-19-51(50)61)43-30-42(57(6,7)8)31-44(33-43)63-45-34-52-54(59-35-45)48-14-9-10-17-49(48)62(52)53-32-41(28-29-58-53)56(3,4)5;1-54(2,3)39-28-29-56-51(32-39)60-47-25-14-13-22-46(47)52-50(60)34-43(35-57-52)61-42-31-40(55(4,5)6)30-41(33-42)58-36-59(49-27-16-15-26-48(49)58)53-44(37-18-9-7-10-19-37)23-17-24-45(53)38-20-11-8-12-21-38;1-35-22-24-36(25-23-35)42-17-15-18-44(54(8,9)10)51(42)58-34-57(46-20-13-14-21-47(46)58)39-28-38(53(5,6)7)29-40(31-39)60-41-32-48-50(56-33-41)43-16-11-12-19-45(43)59(48)49-30-37(26-27-55-49)52(2,3)4;1-34-16-15-17-35(2)50(34)43-19-10-11-20-44(43)55-33-54(46-22-13-14-23-47(46)55)38-28-37(52(6,7)8)29-40(31-38)57-39-24-25-42-41-18-9-12-21-45(41)56(48(42)32-39)49-30-36(26-27-53-49)51(3,4)5;;;;;/h2*9-32,35H,1-8H3;7-32,35H,1-6H3;11-30,33H,1-10H3;9-30H,1-8H3;;;;;/q;;;;;5*+2/i1D3,2D3,13D,15D,16D,20D,21D,22D,23D,24D,25D,26D,27D;1D3,2D3,20D,21D,22D,23D,24D,25D,26D,27D;7D,8D,9D,10D,11D,12D,17D,18D,19D,20D,21D,23D,24D;1D3,22D,23D,24D,25D;1D3,2D3,9D,12D,18D,21D;;;;;
InChIKeyRITLSEHKCOSIEE-DXRSUUNZSA-N
XLogP69.48
TPSA216.91 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds40
Heavy Atoms309
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004997.87
LogP ≤ 569.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze 3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+)) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

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
9-(4-tert-butyl-2-pyridinyl)-7-[3-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]oxy-8H-pyrido[3,4-b]indol-8-ide;platinum(2+)
CID 162465828
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
2-[3-tert-butyl-5-[3-[2-(3,5-difluorophenyl)-6-phenylphenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum(2+)
CID 172531489
2-[3-tert-butyl-5-[3-[2-(3,5-difluorophenyl)-6-[3,5-di(propan-2-yl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum(2+)
CID 172531049
2-[3-[3-[2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-pyridin-2-yl-1H-carbazol-1-ide;platinum(2+)
CID 168799520
2-[3-[3-[4-tert-butyl-2,6-bis(4-fluorophenyl)phenyl]benzimidazole-1,3-diium-1-yl]-5-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum(2+)
CID 172530400
2-[3-(2-tert-butylphenyl)-5-[3-[2-(3,5-difluorophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum(2+)
CID 172530762
3-[3-[2,6-bis(4-fluorophenyl)phenyl]benzimidazole-1,3-diium-1-yl]-5-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]-N,N-diphenylbenzene-4-id-1-amine;platinum(2+)
CID 172530970
5-(4-tert-butyl-2-pyridinyl)-7-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]phenoxy]pyrido[3,2-b]indole
CID 158483499
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
CID 171047729
CID 171047729

Frequently Asked Questions

What is the IUPAC name of 3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+))?
The IUPAC name of 3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+)) (CID 158576507) is 3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+)).
What is the SMILES notation for 3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+))?
The canonical SMILES for 3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+)) is [2H]c1c([2H])c(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c([N+]2=C=[N+](c3[c-]c(Oc4[c-]c5c(nc4)c4ccccc4n5-c4cc(C(C)(C)C)ccn4)cc(C(C)(C)C)c3)c3ccccc32)c(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[2H]c1c([2H])c(C([2H])([2H])[2H])c([2H])c([2H])c1-c1cccc(-c2c([2H])c([2H])c(C([2H])([2H])[2H])c([2H])c2[2H])c1[N+]1=C=[N+](c2[c-]c(Oc3[c-]c4c(nc3)c3ccccc3n4-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-c1cccc(C(C)(C)C)c1[N+]1=C=[N+](c2[c-]c(Oc3[c-]c4c(nc3)c3ccccc3n4-c3cc(C(C)(C)C)ccn3)cc(C(C)(C)C)c2)c2ccccc21.[2H]c1c([2H])c([2H])c(-c2c([2H])c([2H])c([2H])c(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2[N+]2=C=[N+](c3[c-]c(Oc4[c-]c5c(nc4)c4ccccc4n5-c4cc(C(C)(C)C)ccn4)cc(C(C)(C)C)c3)c3ccccc32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c2c(c1[2H])c1ccc(Oc3[c-]c([N+]4=C=[N+](c5ccccc5-c5c(C([2H])([2H])[2H])cccc5C([2H])([2H])[2H])c5ccccc54)cc(C(C)(C)C)c3)[c-]c1n2-c1cc(C(C)(C)C)ccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of 3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+))?
The InChIKey is RITLSEHKCOSIEE-DXRSUUNZSA-N. The full InChI is InChI=1S/2C57H49N5O.C55H45N5O.C54H51N5O.C52H46N4O.5Pt/c2*1-37-20-24-39(25-21-37)46-15-13-16-47(40-26-22-38(2)23-27-40)55(46)61-36-60(50-18-11-12-19-51(50)61)43-30-42(57(6,7)8)31-44(33-43)63-45-34-52-54(59-35-45)48-14-9-10-17-49(48)62(52)53-32-41(28-29-58-53)56(3,4)5;1-54(2,3)39-28-29-56-51(32-39)60-47-25-14-13-22-46(47)52-50(60)34-43(35-57-52)61-42-31-40(55(4,5)6)30-41(33-42)58-36-59(49-27-16-15-26-48(49)58)53-44(37-18-9-7-10-19-37)23-17-24-45(53)38-20-11-8-12-21-38;1-35-22-24-36(25-23-35)42-17-15-18-44(54(8,9)10)51(42)58-34-57(46-20-13-14-21-47(46)58)39-28-38(53(5,6)7)29-40(31-39)60-41-32-48-50(56-33-41)43-16-11-12-19-45(43)59(48)49-30-37(26-27-55-49)52(2,3)4;1-34-16-15-17-35(2)50(34)43-19-10-11-20-44(43)55-33-54(46-22-13-14-23-47(46)55)38-28-37(52(6,7)8)29-40(31-38)57-39-24-25-42-41-18-9-12-21-45(41)56(48(42)32-39)49-30-36(26-27-53-49)51(3,4)5;;;;;/h2*9-32,35H,1-8H3;7-32,35H,1-6H3;11-30,33H,1-10H3;9-30H,1-8H3;;;;;/q;;;;;5*+2/i1D3,2D3,13D,15D,16D,20D,21D,22D,23D,24D,25D,26D,27D;1D3,2D3,20D,21D,22D,23D,24D,25D,26D,27D;7D,8D,9D,10D,11D,12D,17D,18D,19D,20D,21D,23D,24D;1D3,22D,23D,24D,25D;1D3,2D3,9D,12D,18D,21D;;;;;.
What are the key properties of 3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+))?
3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+)) has a molecular weight of 4997.87 g/mol, XLogP of 69.48, 40 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[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)-4H-pyrido[3,2-b]indol-4-ide;2-[3-[3-[2-[2,6-bis(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]-5-tert-butylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-5,6,7,8-tetradeuterio-1H-carbazol-1-ide;3-[3-tert-butyl-5-[3-[2-tert-butyl-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-5-(4-tert-butyl-2-pyridinyl)-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;5-(4-tert-butyl-2-pyridinyl)-3-[3-tert-butyl-5-[3-[3,4,5-trideuterio-2,6-bis[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]benzimidazole-1,3-diium-1-yl]benzene-6-id-1-yl]oxy-4H-pyrido[3,2-b]indol-4-ide;pentakis(platinum(2+)) is sourced from PubChem (CID 158576507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).