2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine

C234H222F4N11O3Pt4-3 — CID 163759081

IUPAC2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine
SMILESCC(C)(c1cccc(-c2[c-]cc3ccc(-c4ccccc4)cc3c2)n1)c1nc(-c2[c-]c3ccccc3cc2)cc2c1C(F)(F)C(c1ccccc1)C2(F)F.[2H]C(C)(C)c1cccc(C([2H])(C)C)c1-c1ccnc(-c2[c-]c(-c3cccc4c3nc(-c3ccc(C(C)(C)C)cc3O)n4-c3cc4c(cc3C(C)(C)C)C([2H])([2H])C([2H])(c3ccccc3)C4([2H])[2H])cc(C(C)(C)C)c2)c1.[2H]C([2H])([2H])c1cc2c(cc1-n1c(-c3ccccc3O)nc3c(-c4[c-]c(-c5cc(-c6c(C([2H])(C)C)cccc6C([2H])(C)C)ccn5)cc(C(C)(C)C)c4)cccc31)C(C)(C)C([2H])(c1ccccc1)C2(C)C.[2H]C1(c2ccccc2)C(C)(C)c2ccc(-c3ccnc(-c4[c-]c(-c5cccc6c5nc(-c5ccc(C(C)(C)C)cc5O)n6-c5ccccc5-c5ccccc5)cc(C(C)(C)C)c4)c3)cc2C1(C)C.[Pt+2].[Pt].[Pt].[Pt]
InChIInChI=1S/C63H60N3O.C63H68N3O.C60H62N3O.C48H32F4N2.4Pt/c1-60(2,3)46-29-30-50(56(67)39-46)59-65-57-49(25-19-27-55(57)66(59)54-26-18-17-24-48(54)40-20-13-11-14-21-40)44-34-45(36-47(35-44)61(4,5)6)53-38-43(32-33-64-53)42-28-31-51-52(37-42)63(9,10)58(62(51,7)8)41-22-15-12-16-23-41;1-38(2)49-21-17-22-50(39(3)4)58(49)41-27-28-64-54(35-41)46-31-45(32-48(33-46)62(8,9)10)51-23-18-24-55-59(51)65-60(52-26-25-47(37-57(52)67)61(5,6)7)66(55)56-36-44-30-42(40-19-15-14-16-20-40)29-43(44)34-53(56)63(11,12)13;1-36(2)44-23-18-24-45(37(3)4)54(44)40-28-29-61-50(34-40)42-31-41(32-43(33-42)58(6,7)8)46-25-19-26-51-55(46)62-57(47-22-16-17-27-53(47)64)63(51)52-35-49-48(30-38(52)5)59(9,10)56(60(49,11)12)39-20-14-13-15-21-39;1-46(2,42-19-11-18-40(53-42)36-24-22-32-20-23-35(27-38(32)28-36)30-12-5-3-6-13-30)45-43-39(47(49,50)44(48(43,51)52)33-15-7-4-8-16-33)29-41(54-45)37-25-21-31-14-9-10-17-34(31)26-37;;;;/h11-33,35-39,58,67H,1-10H3;14-28,32-39,42,67H,29-30H2,1-13H3;13-30,32-37,56,64H,1-12H3;3-23,25,27-29,44H,1-2H3;;;;/q3*-1;-2;;;;+2/i58D;29D2,30D2,38D,39D,42D;5D3,36D,37D,56D;;;;;
InChIKeyWOSYZRZLLIOJJU-QJKVLHSXSA-N
MW4106.81 g/mol
LogP61.31
Rot. Bonds30

About 2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine

2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine (PubChem CID 163759081) has the molecular formula C234H222F4N11O3Pt4-3 and a molecular weight of 4106.81 g/mol. Its IUPAC name is 2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine.

Molecular Properties

Compound Name2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine
PubChem CID163759081
Molecular FormulaC234H222F4N11O3Pt4-3
Molecular Weight4106.81 g/mol
Exact Mass4103.70
IUPAC Name2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine
SMILESCC(C)(c1cccc(-c2[c-]cc3ccc(-c4ccccc4)cc3c2)n1)c1nc(-c2[c-]c3ccccc3cc2)cc2c1C(F)(F)C(c1ccccc1)C2(F)F.[2H]C(C)(C)c1cccc(C([2H])(C)C)c1-c1ccnc(-c2[c-]c(-c3cccc4c3nc(-c3ccc(C(C)(C)C)cc3O)n4-c3cc4c(cc3C(C)(C)C)C([2H])([2H])C([2H])(c3ccccc3)C4([2H])[2H])cc(C(C)(C)C)c2)c1.[2H]C([2H])([2H])c1cc2c(cc1-n1c(-c3ccccc3O)nc3c(-c4[c-]c(-c5cc(-c6c(C([2H])(C)C)cccc6C([2H])(C)C)ccn5)cc(C(C)(C)C)c4)cccc31)C(C)(C)C([2H])(c1ccccc1)C2(C)C.[2H]C1(c2ccccc2)C(C)(C)c2ccc(-c3ccnc(-c4[c-]c(-c5cccc6c5nc(-c5ccc(C(C)(C)C)cc5O)n6-c5ccccc5-c5ccccc5)cc(C(C)(C)C)c4)c3)cc2C1(C)C.[Pt+2].[Pt].[Pt].[Pt]
InChIInChI=1S/C63H60N3O.C63H68N3O.C60H62N3O.C48H32F4N2.4Pt/c1-60(2,3)46-29-30-50(56(67)39-46)59-65-57-49(25-19-27-55(57)66(59)54-26-18-17-24-48(54)40-20-13-11-14-21-40)44-34-45(36-47(35-44)61(4,5)6)53-38-43(32-33-64-53)42-28-31-51-52(37-42)63(9,10)58(62(51,7)8)41-22-15-12-16-23-41;1-38(2)49-21-17-22-50(39(3)4)58(49)41-27-28-64-54(35-41)46-31-45(32-48(33-46)62(8,9)10)51-23-18-24-55-59(51)65-60(52-26-25-47(37-57(52)67)61(5,6)7)66(55)56-36-44-30-42(40-19-15-14-16-20-40)29-43(44)34-53(56)63(11,12)13;1-36(2)44-23-18-24-45(37(3)4)54(44)40-28-29-61-50(34-40)42-31-41(32-43(33-42)58(6,7)8)46-25-19-26-51-55(46)62-57(47-22-16-17-27-53(47)64)63(51)52-35-49-48(30-38(52)5)59(9,10)56(60(49,11)12)39-20-14-13-15-21-39;1-46(2,42-19-11-18-40(53-42)36-24-22-32-20-23-35(27-38(32)28-36)30-12-5-3-6-13-30)45-43-39(47(49,50)44(48(43,51)52)33-15-7-4-8-16-33)29-41(54-45)37-25-21-31-14-9-10-17-34(31)26-37;;;;/h11-33,35-39,58,67H,1-10H3;14-28,32-39,42,67H,29-30H2,1-13H3;13-30,32-37,56,64H,1-12H3;3-23,25,27-29,44H,1-2H3;;;;/q3*-1;-2;;;;+2/i58D;29D2,30D2,38D,39D,42D;5D3,36D,37D,56D;;;;;
InChIKeyWOSYZRZLLIOJJU-QJKVLHSXSA-N
XLogP61.31
TPSA178.60 Ų
H-Bond Donors3
H-Bond Acceptors14
Rotatable Bonds30
Heavy Atoms256
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004106.81
LogP ≤ 561.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1014

Analyze 2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine with MolForge

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Launch Full Analysis

Related Compounds

3-tert-butyl-N-[2-tert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-6-[10-(trifluoromethyl)benzo[g]quinazolin-4-yl]pyridin-2-amine;9-(4-tert-butyl-2-pyridinyl)-N-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]pyrido[2,3-b]indol-2-amine;2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[4-tert-butyl-6-[(4-phenyl-2-pyridinyl)amino]-2-pyridinyl]benzimidazol-2-yl]phenol;platinum;platinum(2+)
CID 157080983
CID 157462522
CID 157462522
CID 157617296
CID 157617296
CID 158157518
CID 158157518
CID 158239006
CID 158239006
CID 158431192
CID 158431192
Benzenesulfonyl-[2-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]azanide;5-fluoro-2-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenol;1-(3-phenyl-3a,7a-dihydroimidazo[4,5-b]pyridin-2-yl)naphthalen-2-ol;2-(3-phenylimidazo[4,5-b]pyridin-2-yl)pyren-1-ol;2-[3-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol;ZINC
CID 158578822
CID 158636196
CID 158636196
4-N,4-N-bis[2,5-dimethyl-4-(N-(3-methylphenyl)anilino)phenyl]-2,5-dimethyl-1-N-(3-methylphenyl)-1-N-phenylbenzene-1,4-diamine;1-[4,6-bis[2-(trifluoromethyl)benzimidazol-1-yl]-1,3,5-triazin-2-yl]-2-(trifluoromethyl)benzimidazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;tri(quinolin-8-yloxy)alumane
CID 158788116
CID 159096807
CID 159096807
2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;7,7-dimethyl-1,11-dihydrobenzo[a]phenalene-1,11-diide;3-(2,6-dimethylphenyl)-8-methyl-4-aza-1-azoniapentacyclo[13.2.1.04,17.05,10.011,16]octadeca-1(17),2,5(10),6,8,11,13,15-octaene;N,N-diphenyl-6H-pyrido[2,1-a]isoindol-5-ium-2-amine;bis(4-hydroxypent-3-en-2-one);tris(iridium);5-methyl-2-phenylpyridine;1-phenylisoquinoline;platinum;2-[4-(trifluoromethyl)benzene-6-id-1-yl]quinoline
CID 159471047
CID 159570252
CID 159570252

Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine?
The IUPAC name of 2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine (CID 163759081) is 2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine.
What is the SMILES notation for 2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine?
The canonical SMILES for 2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine is CC(C)(c1cccc(-c2[c-]cc3ccc(-c4ccccc4)cc3c2)n1)c1nc(-c2[c-]c3ccccc3cc2)cc2c1C(F)(F)C(c1ccccc1)C2(F)F.[2H]C(C)(C)c1cccc(C([2H])(C)C)c1-c1ccnc(-c2[c-]c(-c3cccc4c3nc(-c3ccc(C(C)(C)C)cc3O)n4-c3cc4c(cc3C(C)(C)C)C([2H])([2H])C([2H])(c3ccccc3)C4([2H])[2H])cc(C(C)(C)C)c2)c1.[2H]C([2H])([2H])c1cc2c(cc1-n1c(-c3ccccc3O)nc3c(-c4[c-]c(-c5cc(-c6c(C([2H])(C)C)cccc6C([2H])(C)C)ccn5)cc(C(C)(C)C)c4)cccc31)C(C)(C)C([2H])(c1ccccc1)C2(C)C.[2H]C1(c2ccccc2)C(C)(C)c2ccc(-c3ccnc(-c4[c-]c(-c5cccc6c5nc(-c5ccc(C(C)(C)C)cc5O)n6-c5ccccc5-c5ccccc5)cc(C(C)(C)C)c4)c3)cc2C1(C)C.[Pt+2].[Pt].[Pt].[Pt].
What is the InChIKey of 2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine?
The InChIKey is WOSYZRZLLIOJJU-QJKVLHSXSA-N. The full InChI is InChI=1S/C63H60N3O.C63H68N3O.C60H62N3O.C48H32F4N2.4Pt/c1-60(2,3)46-29-30-50(56(67)39-46)59-65-57-49(25-19-27-55(57)66(59)54-26-18-17-24-48(54)40-20-13-11-14-21-40)44-34-45(36-47(35-44)61(4,5)6)53-38-43(32-33-64-53)42-28-31-51-52(37-42)63(9,10)58(62(51,7)8)41-22-15-12-16-23-41;1-38(2)49-21-17-22-50(39(3)4)58(49)41-27-28-64-54(35-41)46-31-45(32-48(33-46)62(8,9)10)51-23-18-24-55-59(51)65-60(52-26-25-47(37-57(52)67)61(5,6)7)66(55)56-36-44-30-42(40-19-15-14-16-20-40)29-43(44)34-53(56)63(11,12)13;1-36(2)44-23-18-24-45(37(3)4)54(44)40-28-29-61-50(34-40)42-31-41(32-43(33-42)58(6,7)8)46-25-19-26-51-55(46)62-57(47-22-16-17-27-53(47)64)63(51)52-35-49-48(30-38(52)5)59(9,10)56(60(49,11)12)39-20-14-13-15-21-39;1-46(2,42-19-11-18-40(53-42)36-24-22-32-20-23-35(27-38(32)28-36)30-12-5-3-6-13-30)45-43-39(47(49,50)44(48(43,51)52)33-15-7-4-8-16-33)29-41(54-45)37-25-21-31-14-9-10-17-34(31)26-37;;;;/h11-33,35-39,58,67H,1-10H3;14-28,32-39,42,67H,29-30H2,1-13H3;13-30,32-37,56,64H,1-12H3;3-23,25,27-29,44H,1-2H3;;;;/q3*-1;-2;;;;+2/i58D;29D2,30D2,38D,39D,42D;5D3,36D,37D,56D;;;;;.
What are the key properties of 2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine?
2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine has a molecular weight of 4106.81 g/mol, XLogP of 61.31, 30 rotatable bonds, 3 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine is sourced from PubChem (CID 163759081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).