9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole

C284H180N52 — CID 159960030

IUPAC9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole
SMILES[C-]#[N+]c1cc(-n2c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)c(-n2c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)cc1-c1ccncc1.[C-]#[N+]c1cc(-n2c3ccc(-c4nc(C)nc(C)n4)cc3c3cc(-c4nc(C)nc(C)n4)ccc32)c(-n2c3ccc(-c4nc(C)nc(C)n4)cc3c3cc(-c4nc(C)nc(C)n4)ccc32)cc1-c1ccncc1.[C-]#[N+]c1cc(-n2c3ccccc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)c(-n2c3ccccc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)cc1-c1ccncc1.[C-]#[N+]c1cc(-n2c3ccccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)c(-n2c3ccccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)cc1-c1ccncc1
InChIInChI=1S/C96H58N16.2C66H40N10.C56H42N16/c1-97-78-59-84(112-81-56-71(95-107-89(65-34-18-6-19-35-65)101-90(108-95)66-36-20-7-21-37-66)44-48-75(81)76-49-45-72(57-82(76)112)96-109-91(67-38-22-8-23-39-67)102-92(110-96)68-40-24-9-25-41-68)83(58-77(78)60-50-52-98-53-51-60)111-79-54-69(93-103-85(61-26-10-2-11-27-61)99-86(104-93)62-28-12-3-13-29-62)42-46-73(79)74-47-43-70(55-80(74)111)94-105-87(63-30-14-4-15-31-63)100-88(106-94)64-32-16-5-17-33-64;1-67-54-41-60(76-56-29-17-15-27-50(56)53-39-48(31-33-58(53)76)66-73-63(45-22-10-4-11-23-45)70-64(74-66)46-24-12-5-13-25-46)59(40-51(54)42-34-36-68-37-35-42)75-55-28-16-14-26-49(55)52-38-47(30-32-57(52)75)65-71-61(43-18-6-2-7-19-43)69-62(72-65)44-20-8-3-9-21-44;1-67-54-41-60(76-56-29-17-15-27-50(56)52-33-31-48(39-58(52)76)66-73-63(45-22-10-4-11-23-45)70-64(74-66)46-24-12-5-13-25-46)59(40-53(54)42-34-36-68-37-35-42)75-55-28-16-14-26-49(55)51-32-30-47(38-57(51)75)65-71-61(43-18-6-2-7-19-43)69-62(72-65)44-20-8-3-9-21-44;1-28-59-29(2)64-53(63-28)37-10-14-47-42(22-37)43-23-38(54-65-30(3)60-31(4)66-54)11-15-48(43)71(47)51-26-41(36-18-20-58-21-19-36)46(57-9)27-52(51)72-49-16-12-39(55-67-32(5)61-33(6)68-55)24-44(49)45-25-40(13-17-50(45)72)56-69-34(7)62-35(8)70-56/h2-59H;2*2-41H;10-27H,1-8H3
InChIKeyODFCLNQQSAVCAE-UHFFFAOYSA-N
MW4320.93 g/mol
LogP65.34
Rot. Bonds40

About 9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole

9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole (PubChem CID 159960030) has the molecular formula C284H180N52 and a molecular weight of 4320.93 g/mol. Its IUPAC name is 9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole.

Molecular Properties

Compound Name9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole
PubChem CID159960030
Molecular FormulaC284H180N52
Molecular Weight4320.93 g/mol
Exact Mass4317.57
IUPAC Name9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole
SMILES[C-]#[N+]c1cc(-n2c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)c(-n2c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)cc1-c1ccncc1.[C-]#[N+]c1cc(-n2c3ccc(-c4nc(C)nc(C)n4)cc3c3cc(-c4nc(C)nc(C)n4)ccc32)c(-n2c3ccc(-c4nc(C)nc(C)n4)cc3c3cc(-c4nc(C)nc(C)n4)ccc32)cc1-c1ccncc1.[C-]#[N+]c1cc(-n2c3ccccc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)c(-n2c3ccccc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)cc1-c1ccncc1.[C-]#[N+]c1cc(-n2c3ccccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)c(-n2c3ccccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)cc1-c1ccncc1
InChIInChI=1S/C96H58N16.2C66H40N10.C56H42N16/c1-97-78-59-84(112-81-56-71(95-107-89(65-34-18-6-19-35-65)101-90(108-95)66-36-20-7-21-37-66)44-48-75(81)76-49-45-72(57-82(76)112)96-109-91(67-38-22-8-23-39-67)102-92(110-96)68-40-24-9-25-41-68)83(58-77(78)60-50-52-98-53-51-60)111-79-54-69(93-103-85(61-26-10-2-11-27-61)99-86(104-93)62-28-12-3-13-29-62)42-46-73(79)74-47-43-70(55-80(74)111)94-105-87(63-30-14-4-15-31-63)100-88(106-94)64-32-16-5-17-33-64;1-67-54-41-60(76-56-29-17-15-27-50(56)53-39-48(31-33-58(53)76)66-73-63(45-22-10-4-11-23-45)70-64(74-66)46-24-12-5-13-25-46)59(40-51(54)42-34-36-68-37-35-42)75-55-28-16-14-26-49(55)52-38-47(30-32-57(52)75)65-71-61(43-18-6-2-7-19-43)69-62(72-65)44-20-8-3-9-21-44;1-67-54-41-60(76-56-29-17-15-27-50(56)52-33-31-48(39-58(52)76)66-73-63(45-22-10-4-11-23-45)70-64(74-66)46-24-12-5-13-25-46)59(40-53(54)42-34-36-68-37-35-42)75-55-28-16-14-26-49(55)51-32-30-47(38-57(51)75)65-71-61(43-18-6-2-7-19-43)69-62(72-65)44-20-8-3-9-21-44;1-28-59-29(2)64-53(63-28)37-10-14-47-42(22-37)43-23-38(54-65-30(3)60-31(4)66-54)11-15-48(43)71(47)51-26-41(36-18-20-58-21-19-36)46(57-9)27-52(51)72-49-16-12-39(55-67-32(5)61-33(6)68-55)24-44(49)45-25-40(13-17-50(45)72)56-69-34(7)62-35(8)70-56/h2-59H;2*2-41H;10-27H,1-8H3
InChIKeyODFCLNQQSAVCAE-UHFFFAOYSA-N
XLogP65.34
TPSA572.48 Ų
H-Bond Donors
H-Bond Acceptors48
Rotatable Bonds40
Heavy Atoms336
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004320.93
LogP ≤ 565.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1048

Analyze 9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole with MolForge

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Launch Full Analysis

Related Compounds

9-[4-[3,6-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
CID 134296233
4,5-bis[2,7-bis(2-methylphenyl)carbazol-9-yl]-2-pyridin-4-ylbenzonitrile;9-[2-[3,6-bis(2-methylphenyl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(2-methylphenyl)carbazole;9-[4-isocyano-2-[3-(2-methylphenyl)carbazol-9-yl]-5-pyridin-4-ylphenyl]-3-(2-methylphenyl)carbazole
CID 157242392
9-[4-isocyano-5-pyridin-4-yl-2-[3-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-3-(2,4,6-trimethylphenyl)carbazole
CID 140846562
9-[2-[2,7-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-(2,6-dimethyl-4-pyridinyl)-5-isocyanophenyl]-2,7-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole
CID 140846517
3-carbazol-9-yl-9-[2-(3-carbazol-9-ylcarbazol-9-yl)-4-isocyano-5-pyridin-4-ylphenyl]carbazole
CID 140846577
3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[2-(2,6-diphenylpyrimidin-4-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(2,6-diphenylpyrimidin-4-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;9-[2-(2,6-diphenylpyrimidin-4-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
CID 161333862
9-[2-(2,7-dimethylcarbazol-9-yl)-4-isocyano-5-pyridin-4-ylphenyl]-2,7-dimethylcarbazole
CID 140846679
4-(4,6-dimethyl-1,3,5-triazin-2-yl)-2-[2-(2-isocyanophenyl)carbazol-9-yl]benzonitrile
CID 140871885
3,5-bis[2,7-bis(3-cyano-5-isocyanophenyl)carbazol-9-yl]-4-pyridin-4-ylbenzonitrile;3,5-bis[2-(3-cyano-5-isocyanophenyl)carbazol-9-yl]-4-pyridin-4-ylbenzonitrile;3,5-bis[3-(3-cyano-5-isocyanophenyl)carbazol-9-yl]-4-pyridin-4-ylbenzonitrile;3,5-bis[2-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-pyridin-4-ylbenzonitrile;3,5-bis[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-pyridin-4-ylbenzonitrile;5-[9-[5-cyano-3-[3-(3-cyano-5-isocyanophenyl)-6-(3,5-diisocyanophenyl)carbazol-9-yl]-2-pyridin-4-ylphenyl]-6-(3-cyano-5-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile
CID 160522241
2,7-di(carbazol-9-yl)-9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridin-4-ylphenyl]carbazole
CID 167262180
9-[4-(4,6-diphenylpyrimidin-2-yl)-5-isocyano-2-[3-(4-methylphenyl)carbazol-9-yl]phenyl]-3-(4-methylphenyl)carbazole
CID 161310460
9-[2-[2,7-bis(2,4-dimethylphenyl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(2,4-dimethylphenyl)carbazole
CID 153494743

Frequently Asked Questions

What is the IUPAC name of 9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole?
The IUPAC name of 9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole (CID 159960030) is 9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole.
What is the SMILES notation for 9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole?
The canonical SMILES for 9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole is [C-]#[N+]c1cc(-n2c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)c(-n2c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)cc1-c1ccncc1.[C-]#[N+]c1cc(-n2c3ccc(-c4nc(C)nc(C)n4)cc3c3cc(-c4nc(C)nc(C)n4)ccc32)c(-n2c3ccc(-c4nc(C)nc(C)n4)cc3c3cc(-c4nc(C)nc(C)n4)ccc32)cc1-c1ccncc1.[C-]#[N+]c1cc(-n2c3ccccc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)c(-n2c3ccccc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)cc1-c1ccncc1.[C-]#[N+]c1cc(-n2c3ccccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)c(-n2c3ccccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)cc1-c1ccncc1.
What is the InChIKey of 9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole?
The InChIKey is ODFCLNQQSAVCAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C96H58N16.2C66H40N10.C56H42N16/c1-97-78-59-84(112-81-56-71(95-107-89(65-34-18-6-19-35-65)101-90(108-95)66-36-20-7-21-37-66)44-48-75(81)76-49-45-72(57-82(76)112)96-109-91(67-38-22-8-23-39-67)102-92(110-96)68-40-24-9-25-41-68)83(58-77(78)60-50-52-98-53-51-60)111-79-54-69(93-103-85(61-26-10-2-11-27-61)99-86(104-93)62-28-12-3-13-29-62)42-46-73(79)74-47-43-70(55-80(74)111)94-105-87(63-30-14-4-15-31-63)100-88(106-94)64-32-16-5-17-33-64;1-67-54-41-60(76-56-29-17-15-27-50(56)53-39-48(31-33-58(53)76)66-73-63(45-22-10-4-11-23-45)70-64(74-66)46-24-12-5-13-25-46)59(40-51(54)42-34-36-68-37-35-42)75-55-28-16-14-26-49(55)52-38-47(30-32-57(52)75)65-71-61(43-18-6-2-7-19-43)69-62(72-65)44-20-8-3-9-21-44;1-67-54-41-60(76-56-29-17-15-27-50(56)52-33-31-48(39-58(52)76)66-73-63(45-22-10-4-11-23-45)70-64(74-66)46-24-12-5-13-25-46)59(40-53(54)42-34-36-68-37-35-42)75-55-28-16-14-26-49(55)51-32-30-47(38-57(51)75)65-71-61(43-18-6-2-7-19-43)69-62(72-65)44-20-8-3-9-21-44;1-28-59-29(2)64-53(63-28)37-10-14-47-42(22-37)43-23-38(54-65-30(3)60-31(4)66-54)11-15-48(43)71(47)51-26-41(36-18-20-58-21-19-36)46(57-9)27-52(51)72-49-16-12-39(55-67-32(5)61-33(6)68-55)24-44(49)45-25-40(13-17-50(45)72)56-69-34(7)62-35(8)70-56/h2-59H;2*2-41H;10-27H,1-8H3.
What are the key properties of 9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole?
9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole has a molecular weight of 4320.93 g/mol, XLogP of 65.34, 40 rotatable bonds, 0 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]-2,7-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyano-5-pyridin-4-ylphenyl]carbazole is sourced from PubChem (CID 159960030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).