9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole

C290H213N35 — CID 157250144

IUPAC9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole
SMILESCC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1c(-c2ccccn2)cccc1-c1nc(-c2ccccc2)nc(-c2cccc(-c3ccccn3)c2-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)n1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1c(-c2ccccn2)cccc1-c1nc(-c2ccccc2)nc(-c2cccc(-c3ccccn3)c2-n2c3ccc(C)cc3c3cc(C)ccc32)n1.c1ccc(-c2nc(-c3cccc(-c4ccccn4)c3-n3c4ccccc4c4ccccc43)nc(-c3cccc(-c4ccccn4)c3-n3c4ccccc4c4ccccc43)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccccn4)c3-n3c4ccccc4c4ccncc43)nc(-c3cccc(-c4ccccn4)c3-n3c4ccccc4c4ccncc43)n2)cc1.c1ccc(C(c2ccccc2)(c2ccccc2)c2cccc(-c3nc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c2)cc1
InChIInChI=1S/C71H67N7.C59H43N7.C55H35N7.C53H33N9.C52H35N5/c1-68(2,3)45-30-34-59-53(40-45)54-41-46(69(4,5)6)31-35-60(54)77(59)63-49(57-28-16-18-38-72-57)24-20-26-51(63)66-74-65(44-22-14-13-15-23-44)75-67(76-66)52-27-21-25-50(58-29-17-19-39-73-58)64(52)78-61-36-32-47(70(7,8)9)42-55(61)56-43-48(71(10,11)12)33-37-62(56)78;1-36-22-26-51-45(32-36)46-33-37(2)23-27-52(46)65(51)55-41(49-20-8-10-30-60-49)16-12-18-43(55)58-62-57(40-14-6-5-7-15-40)63-59(64-58)44-19-13-17-42(50-21-9-11-31-61-50)56(44)66-53-28-24-38(3)34-47(53)48-35-39(4)25-29-54(48)66;1-2-18-36(19-3-1)53-58-54(43-26-16-24-41(45-28-12-14-34-56-45)51(43)61-47-30-8-4-20-37(47)38-21-5-9-31-48(38)61)60-55(59-53)44-27-17-25-42(46-29-13-15-35-57-46)52(44)62-49-32-10-6-22-39(49)40-23-7-11-33-50(40)62;1-2-14-34(15-3-1)51-58-52(41-20-12-18-39(43-22-8-10-28-56-43)49(41)61-45-24-6-4-16-35(45)37-26-30-54-32-47(37)61)60-53(59-51)42-21-13-19-40(44-23-9-11-29-57-44)50(42)62-46-25-7-5-17-36(46)38-27-31-55-33-48(38)62;1-4-20-37(21-5-1)52(38-22-6-2-7-23-38,39-24-8-3-9-25-39)40-26-18-19-36(35-40)49-53-50(56-45-31-14-10-27-41(45)42-28-11-15-32-46(42)56)55-51(54-49)57-47-33-16-12-29-43(47)44-30-13-17-34-48(44)57/h13-43H,1-12H3;5-35H,1-4H3;1-35H;1-33H;1-35H
InChIKeyAWFYVBBURAKDTI-UHFFFAOYSA-N
MW4188.14 g/mol
LogP70.09
Rot. Bonds35

About 9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole

9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole (PubChem CID 157250144) has the molecular formula C290H213N35 and a molecular weight of 4188.14 g/mol. Its IUPAC name is 9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole.

Molecular Properties

Compound Name9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole
PubChem CID157250144
Molecular FormulaC290H213N35
Molecular Weight4188.14 g/mol
Exact Mass4184.77
IUPAC Name9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole
SMILESCC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1c(-c2ccccn2)cccc1-c1nc(-c2ccccc2)nc(-c2cccc(-c3ccccn3)c2-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)n1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1c(-c2ccccn2)cccc1-c1nc(-c2ccccc2)nc(-c2cccc(-c3ccccn3)c2-n2c3ccc(C)cc3c3cc(C)ccc32)n1.c1ccc(-c2nc(-c3cccc(-c4ccccn4)c3-n3c4ccccc4c4ccccc43)nc(-c3cccc(-c4ccccn4)c3-n3c4ccccc4c4ccccc43)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccccn4)c3-n3c4ccccc4c4ccncc43)nc(-c3cccc(-c4ccccn4)c3-n3c4ccccc4c4ccncc43)n2)cc1.c1ccc(C(c2ccccc2)(c2ccccc2)c2cccc(-c3nc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c2)cc1
InChIInChI=1S/C71H67N7.C59H43N7.C55H35N7.C53H33N9.C52H35N5/c1-68(2,3)45-30-34-59-53(40-45)54-41-46(69(4,5)6)31-35-60(54)77(59)63-49(57-28-16-18-38-72-57)24-20-26-51(63)66-74-65(44-22-14-13-15-23-44)75-67(76-66)52-27-21-25-50(58-29-17-19-39-73-58)64(52)78-61-36-32-47(70(7,8)9)42-55(61)56-43-48(71(10,11)12)33-37-62(56)78;1-36-22-26-51-45(32-36)46-33-37(2)23-27-52(46)65(51)55-41(49-20-8-10-30-60-49)16-12-18-43(55)58-62-57(40-14-6-5-7-15-40)63-59(64-58)44-19-13-17-42(50-21-9-11-31-61-50)56(44)66-53-28-24-38(3)34-47(53)48-35-39(4)25-29-54(48)66;1-2-18-36(19-3-1)53-58-54(43-26-16-24-41(45-28-12-14-34-56-45)51(43)61-47-30-8-4-20-37(47)38-21-5-9-31-48(38)61)60-55(59-53)44-27-17-25-42(46-29-13-15-35-57-46)52(44)62-49-32-10-6-22-39(49)40-23-7-11-33-50(40)62;1-2-14-34(15-3-1)51-58-52(41-20-12-18-39(43-22-8-10-28-56-43)49(41)61-45-24-6-4-16-35(45)37-26-30-54-32-47(37)61)60-53(59-51)42-21-13-19-40(44-23-9-11-29-57-44)50(42)62-46-25-7-5-17-36(46)38-27-31-55-33-48(38)62;1-4-20-37(21-5-1)52(38-22-6-2-7-23-38,39-24-8-3-9-25-39)40-26-18-19-36(35-40)49-53-50(56-45-31-14-10-27-41(45)42-28-11-15-32-46(42)56)55-51(54-49)57-47-33-16-12-29-43(47)44-30-13-17-34-48(44)57/h13-43H,1-12H3;5-35H,1-4H3;1-35H;1-33H;1-35H
InChIKeyAWFYVBBURAKDTI-UHFFFAOYSA-N
XLogP70.09
TPSA371.55 Ų
H-Bond Donors
H-Bond Acceptors35
Rotatable Bonds35
Heavy Atoms325
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004188.14
LogP ≤ 570.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1035

Analyze 9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole with MolForge

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Related Compounds

12,30-ditert-butyl-20,20,22,22-tetramethyl-43-phenyl-6,36-dipyridin-2-yl-8,34,42,44,45-pentazadecacyclo[39.3.1.115,19.123,27.02,7.08,16.09,14.026,34.028,33.035,40]heptatetraconta-1(45),2,4,6,9(14),10,12,15,17,19(47),23(46),24,26,28(33),29,31,35,37,39,41,43-henicosaene
CID 167100876
9-[2,6-bis(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-ditert-butylcarbazole
CID 149127050
3-tert-butyl-9-[4-(3-tert-butylphenyl)-6-carbazol-9-yl-1,3,5-triazin-2-yl]carbazole
CID 170669493
3-tert-butyl-9-[4-[2-(3-tert-butylcarbazol-9-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-pyridinyl]carbazole;9-[4-[2-(3,6-dimethylcarbazol-9-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-pyridinyl]-3,6-dimethylcarbazole;9-[4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(3-methylcarbazol-9-yl)phenyl]-3-pyridinyl]-3-methylcarbazole
CID 162162461
3,6-ditert-butyl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-pyridin-4-ylphenyl]carbazole
CID 142560218
9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-(3-tritylphenyl)phenyl]-3-methylcarbazole
CID 159546034
9-[2,6-bis(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-dipyridin-2-ylcarbazole
CID 167168656
9-(4,6-diphenylpyrimidin-2-yl)-3-methylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylcarbazole;9-(2,6-dipyridin-2-yl-4-pyridinyl)-3-methylcarbazole;9-(2,6-dipyridin-3-yl-4-pyridinyl)-3-methylcarbazole;9-(2,6-dipyridin-4-yl-4-pyridinyl)-3-methylcarbazole
CID 158717164
9-[4-(2-carbazol-9-yl-3-phenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]carbazole
CID 176837753
9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridin-2-ylphenyl]-3,6-dimethylcarbazole
CID 138579314
9-[2,6-bis(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(2,4-dimethylphenyl)carbazole
CID 167168633
9-[4-[2-(3-tert-butylcarbazol-9-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]-3,6-bis(2-phenylphenyl)carbazole
CID 167285139

Frequently Asked Questions

What is the IUPAC name of 9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole?
The IUPAC name of 9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole (CID 157250144) is 9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole.
What is the SMILES notation for 9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole?
The canonical SMILES for 9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole is CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1c(-c2ccccn2)cccc1-c1nc(-c2ccccc2)nc(-c2cccc(-c3ccccn3)c2-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)n1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1c(-c2ccccn2)cccc1-c1nc(-c2ccccc2)nc(-c2cccc(-c3ccccn3)c2-n2c3ccc(C)cc3c3cc(C)ccc32)n1.c1ccc(-c2nc(-c3cccc(-c4ccccn4)c3-n3c4ccccc4c4ccccc43)nc(-c3cccc(-c4ccccn4)c3-n3c4ccccc4c4ccccc43)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccccn4)c3-n3c4ccccc4c4ccncc43)nc(-c3cccc(-c4ccccn4)c3-n3c4ccccc4c4ccncc43)n2)cc1.c1ccc(C(c2ccccc2)(c2ccccc2)c2cccc(-c3nc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c2)cc1.
What is the InChIKey of 9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole?
The InChIKey is AWFYVBBURAKDTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C71H67N7.C59H43N7.C55H35N7.C53H33N9.C52H35N5/c1-68(2,3)45-30-34-59-53(40-45)54-41-46(69(4,5)6)31-35-60(54)77(59)63-49(57-28-16-18-38-72-57)24-20-26-51(63)66-74-65(44-22-14-13-15-23-44)75-67(76-66)52-27-21-25-50(58-29-17-19-39-73-58)64(52)78-61-36-32-47(70(7,8)9)42-55(61)56-43-48(71(10,11)12)33-37-62(56)78;1-36-22-26-51-45(32-36)46-33-37(2)23-27-52(46)65(51)55-41(49-20-8-10-30-60-49)16-12-18-43(55)58-62-57(40-14-6-5-7-15-40)63-59(64-58)44-19-13-17-42(50-21-9-11-31-61-50)56(44)66-53-28-24-38(3)34-47(53)48-35-39(4)25-29-54(48)66;1-2-18-36(19-3-1)53-58-54(43-26-16-24-41(45-28-12-14-34-56-45)51(43)61-47-30-8-4-20-37(47)38-21-5-9-31-48(38)61)60-55(59-53)44-27-17-25-42(46-29-13-15-35-57-46)52(44)62-49-32-10-6-22-39(49)40-23-7-11-33-50(40)62;1-2-14-34(15-3-1)51-58-52(41-20-12-18-39(43-22-8-10-28-56-43)49(41)61-45-24-6-4-16-35(45)37-26-30-54-32-47(37)61)60-53(59-51)42-21-13-19-40(44-23-9-11-29-57-44)50(42)62-46-25-7-5-17-36(46)38-27-31-55-33-48(38)62;1-4-20-37(21-5-1)52(38-22-6-2-7-23-38,39-24-8-3-9-25-39)40-26-18-19-36(35-40)49-53-50(56-45-31-14-10-27-41(45)42-28-11-15-32-46(42)56)55-51(54-49)57-47-33-16-12-29-43(47)44-30-13-17-34-48(44)57/h13-43H,1-12H3;5-35H,1-4H3;1-35H;1-33H;1-35H.
What are the key properties of 9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole?
9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole has a molecular weight of 4188.14 g/mol, XLogP of 70.09, 35 rotatable bonds, 0 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-[4-(2-carbazol-9-yl-3-pyridin-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[4-carbazol-9-yl-6-(3-tritylphenyl)-1,3,5-triazin-2-yl]carbazole;3,6-ditert-butyl-9-[2-[4-[2-(3,6-ditert-butylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]carbazole;9-[2-[4-[2-(3,6-dimethylcarbazol-9-yl)-3-pyridin-2-ylphenyl]-6-phenyl-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]-3,6-dimethylcarbazole;9-[2-[4-phenyl-6-(3-pyridin-2-yl-2-pyrido[3,4-b]indol-9-ylphenyl)-1,3,5-triazin-2-yl]-6-pyridin-2-ylphenyl]pyrido[3,4-b]indole is sourced from PubChem (CID 157250144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).