3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole

C281H177N31 — CID 160598747

IUPAC3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole
SMILESc1ccc(-c2cc(-n3c4ccc(-c5ccc6ccccc6c5)cc4c4cc(-c5ccc6c(c5)c5cc(-c7ccc8ccccc8c7)ccc5n6-c5nc(-c6ccccc6)cc(-c6ccccc6)n5)ccc43)nc(-c3ccccc3)n2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccc5c(c4)c4cc(-c6ccccc6)ccc4n5-c4nc(-c5ccccc5)cc(-c5ccccc5)n4)ccc2n3-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccc5c(c4)c4cc(-c6ccccc6)ccc4n5-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc2n3-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccc(-c5ccc6c(c5)c5cc(-c7cccc8ccccc78)ccc5n6-c5cc(-c6ncncn6)cc(-c6ncncn6)c5)cc4c4cc(-c5cccc6ccccc56)ccc43)n2)cc1
InChIInChI=1S/C76H48N6.C71H43N11.C68H44N6.C66H42N8/c1-5-19-51(20-6-1)67-47-68(52-21-7-2-8-22-52)79-76(78-67)82-72-39-35-60(58-32-30-50-18-14-16-28-56(50)42-58)44-65(72)66-46-62(36-40-73(66)82)61-34-38-71-64(45-61)63-43-59(57-31-29-49-17-13-15-27-55(49)41-57)33-37-70(63)81(71)74-48-69(53-23-9-3-10-24-53)77-75(80-74)54-25-11-4-12-26-54;1-3-15-46(16-4-1)69-78-70(47-17-5-2-6-18-47)80-71(79-69)82-65-30-26-49(37-60(65)62-39-51(28-32-66(62)82)58-24-12-20-45-14-8-10-22-56(45)58)48-25-29-63-59(36-48)61-38-50(57-23-11-19-44-13-7-9-21-55(44)57)27-31-64(61)81(63)54-34-52(67-74-40-72-41-75-67)33-53(35-54)68-76-42-73-43-77-68;1-7-19-45(20-8-1)51-31-35-63-55(39-51)57-41-53(33-37-65(57)73(63)67-69-59(47-23-11-3-12-24-47)43-60(70-67)48-25-13-4-14-26-48)54-34-38-66-58(42-54)56-40-52(46-21-9-2-10-22-46)32-36-64(56)74(66)68-71-61(49-27-15-5-16-28-49)44-62(72-68)50-29-17-6-18-30-50;1-7-19-43(20-8-1)49-31-35-57-53(39-49)55-41-51(33-37-59(55)73(57)65-69-61(45-23-11-3-12-24-45)67-62(70-65)46-25-13-4-14-26-46)52-34-38-60-56(42-52)54-40-50(44-21-9-2-10-22-44)32-36-58(54)74(60)66-71-63(47-27-15-5-16-28-47)68-64(72-66)48-29-17-6-18-30-48/h1-48H;1-43H;1-44H;1-42H
InChIKeyRDZJUGSHLCRSAH-UHFFFAOYSA-N
MW3987.72 g/mol
LogP68.90
Rot. Bonds36

About 3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole

3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole (PubChem CID 160598747) has the molecular formula C281H177N31 and a molecular weight of 3987.72 g/mol. Its IUPAC name is 3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole.

Molecular Properties

Compound Name3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole
PubChem CID160598747
Molecular FormulaC281H177N31
Molecular Weight3987.72 g/mol
Exact Mass3984.48
IUPAC Name3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole
SMILESc1ccc(-c2cc(-n3c4ccc(-c5ccc6ccccc6c5)cc4c4cc(-c5ccc6c(c5)c5cc(-c7ccc8ccccc8c7)ccc5n6-c5nc(-c6ccccc6)cc(-c6ccccc6)n5)ccc43)nc(-c3ccccc3)n2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccc5c(c4)c4cc(-c6ccccc6)ccc4n5-c4nc(-c5ccccc5)cc(-c5ccccc5)n4)ccc2n3-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccc5c(c4)c4cc(-c6ccccc6)ccc4n5-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc2n3-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccc(-c5ccc6c(c5)c5cc(-c7cccc8ccccc78)ccc5n6-c5cc(-c6ncncn6)cc(-c6ncncn6)c5)cc4c4cc(-c5cccc6ccccc56)ccc43)n2)cc1
InChIInChI=1S/C76H48N6.C71H43N11.C68H44N6.C66H42N8/c1-5-19-51(20-6-1)67-47-68(52-21-7-2-8-22-52)79-76(78-67)82-72-39-35-60(58-32-30-50-18-14-16-28-56(50)42-58)44-65(72)66-46-62(36-40-73(66)82)61-34-38-71-64(45-61)63-43-59(57-31-29-49-17-13-15-27-55(49)41-57)33-37-70(63)81(71)74-48-69(53-23-9-3-10-24-53)77-75(80-74)54-25-11-4-12-26-54;1-3-15-46(16-4-1)69-78-70(47-17-5-2-6-18-47)80-71(79-69)82-65-30-26-49(37-60(65)62-39-51(28-32-66(62)82)58-24-12-20-45-14-8-10-22-56(45)58)48-25-29-63-59(36-48)61-38-50(57-23-11-19-44-13-7-9-21-55(44)57)27-31-64(61)81(63)54-34-52(67-74-40-72-41-75-67)33-53(35-54)68-76-42-73-43-77-68;1-7-19-45(20-8-1)51-31-35-63-55(39-51)57-41-53(33-37-65(57)73(63)67-69-59(47-23-11-3-12-24-47)43-60(70-67)48-25-13-4-14-26-48)54-34-38-66-58(42-54)56-40-52(46-21-9-2-10-22-46)32-36-64(56)74(66)68-71-61(49-27-15-5-16-28-49)44-62(72-68)50-29-17-6-18-30-50;1-7-19-43(20-8-1)49-31-35-57-53(39-49)55-41-51(33-37-59(55)73(57)65-69-61(45-23-11-3-12-24-45)67-62(70-65)46-25-13-4-14-26-46)52-34-38-60-56(42-52)54-40-50(44-21-9-2-10-22-44)32-36-58(54)74(60)66-71-63(47-27-15-5-16-28-47)68-64(72-66)48-29-17-6-18-30-48/h1-48H;1-43H;1-44H;1-42H
InChIKeyRDZJUGSHLCRSAH-UHFFFAOYSA-N
XLogP68.90
TPSA335.91 Ų
H-Bond Donors
H-Bond Acceptors31
Rotatable Bonds36
Heavy Atoms312
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003987.72
LogP ≤ 568.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1031

Analyze 3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole with MolForge

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Related Compounds

3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-(2,6-diphenylpyrimidin-4-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[3,5-di(pyrimidin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 160517705
3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-(2,6-diphenylpyrimidin-4-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[3,5-di(pyrimidin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 159058849
3-[9-[2-phenyl-6-[3-[4-[4-[3-[6-phenyl-2-[3-[9-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]carbazol-3-yl]carbazol-9-yl]pyrimidin-4-yl]phenyl]phenyl]phenyl]phenyl]pyrimidin-4-yl]carbazol-3-yl]-9-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]carbazole
CID 137445193
7-(2,6-diphenylpyrimidin-4-yl)-3-naphthalen-1-ylbenzo[c]carbazole;7-(2,6-diphenylpyrimidin-4-yl)-2-(6-phenylnaphthalen-2-yl)benzo[c]carbazole
CID 159963707
9-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]-3-[9-[6-phenyl-2-(3-phenylphenyl)pyrimidin-4-yl]carbazol-3-yl]carbazole
CID 126700362
3-[4-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]-9-phenylcarbazole;3-[4-[9-(2,6-diphenylpyrimidin-4-yl)carbazol-3-yl]phenyl]-9-phenylcarbazole;3-[4-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]phenyl]-9-phenylcarbazole;3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]phenyl]-9-phenylcarbazole
CID 159539371
2-[9-(2,6-diphenylpyrimidin-4-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;9-(2,6-diphenylpyrimidin-4-yl)-2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]carbazole;2-[9-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-2-yl]-9-phenylcarbazole;3-[9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-2-yl]-9-phenylcarbazole
CID 160766237
9-[3-[4,6-bis(3-phenylphenyl)pyrimidin-2-yl]-5-phenylphenyl]-3-carbazol-9-ylcarbazole;3-carbazol-9-yl-9-[3-(2,6-diphenylpyrimidin-4-yl)-5-phenylphenyl]carbazole;3-carbazol-9-yl-9-[3-(2-naphthalen-2-yl-6-phenylpyrimidin-4-yl)-5-phenylphenyl]carbazole;3-carbazol-9-yl-9-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]carbazole
CID 159279604
3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-2-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-2-yl]-9-phenylcarbazole;3-[9-(2,6-diphenylpyrimidin-4-yl)carbazol-2-yl]-9-phenylcarbazole;3-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-2-yl]-9-phenylcarbazole;2-[9-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-2-yl]-9-phenylcarbazole
CID 157141281
2-[9-(2,6-diphenylpyrimidin-4-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;9-(2,6-diphenylpyrimidin-4-yl)-2-[9-(2,6-diphenylpyrimidin-4-yl)carbazol-3-yl]carbazole;9-(2,6-diphenylpyrimidin-4-yl)-2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]carbazole;2-[9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 161289745
2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-9-phenylcarbazole;2-[9-(2,6-diphenylpyrimidin-4-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;9-(2,6-diphenylpyrimidin-4-yl)-2-[9-(2,6-diphenylpyrimidin-4-yl)carbazol-3-yl]carbazole
CID 159773020
9-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]carbazole;9-[4-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;9-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]carbazole;9-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]carbazole
CID 160561828

Frequently Asked Questions

What is the IUPAC name of 3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole?
The IUPAC name of 3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole (CID 160598747) is 3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole.
What is the SMILES notation for 3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole?
The canonical SMILES for 3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole is c1ccc(-c2cc(-n3c4ccc(-c5ccc6ccccc6c5)cc4c4cc(-c5ccc6c(c5)c5cc(-c7ccc8ccccc8c7)ccc5n6-c5nc(-c6ccccc6)cc(-c6ccccc6)n5)ccc43)nc(-c3ccccc3)n2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccc5c(c4)c4cc(-c6ccccc6)ccc4n5-c4nc(-c5ccccc5)cc(-c5ccccc5)n4)ccc2n3-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccc5c(c4)c4cc(-c6ccccc6)ccc4n5-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc2n3-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccc(-c5ccc6c(c5)c5cc(-c7cccc8ccccc78)ccc5n6-c5cc(-c6ncncn6)cc(-c6ncncn6)c5)cc4c4cc(-c5cccc6ccccc56)ccc43)n2)cc1.
What is the InChIKey of 3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole?
The InChIKey is RDZJUGSHLCRSAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C76H48N6.C71H43N11.C68H44N6.C66H42N8/c1-5-19-51(20-6-1)67-47-68(52-21-7-2-8-22-52)79-76(78-67)82-72-39-35-60(58-32-30-50-18-14-16-28-56(50)42-58)44-65(72)66-46-62(36-40-73(66)82)61-34-38-71-64(45-61)63-43-59(57-31-29-49-17-13-15-27-55(49)41-57)33-37-70(63)81(71)74-48-69(53-23-9-3-10-24-53)77-75(80-74)54-25-11-4-12-26-54;1-3-15-46(16-4-1)69-78-70(47-17-5-2-6-18-47)80-71(79-69)82-65-30-26-49(37-60(65)62-39-51(28-32-66(62)82)58-24-12-20-45-14-8-10-22-56(45)58)48-25-29-63-59(36-48)61-38-50(57-23-11-19-44-13-7-9-21-55(44)57)27-31-64(61)81(63)54-34-52(67-74-40-72-41-75-67)33-53(35-54)68-76-42-73-43-77-68;1-7-19-45(20-8-1)51-31-35-63-55(39-51)57-41-53(33-37-65(57)73(63)67-69-59(47-23-11-3-12-24-47)43-60(70-67)48-25-13-4-14-26-48)54-34-38-66-58(42-54)56-40-52(46-21-9-2-10-22-46)32-36-64(56)74(66)68-71-61(49-27-15-5-16-28-49)44-62(72-68)50-29-17-6-18-30-50;1-7-19-43(20-8-1)49-31-35-57-53(39-49)55-41-51(33-37-59(55)73(57)65-69-61(45-23-11-3-12-24-45)67-62(70-65)46-25-13-4-14-26-46)52-34-38-60-56(42-52)54-40-50(44-21-9-2-10-22-44)32-36-58(54)74(60)66-71-63(47-27-15-5-16-28-47)68-64(72-66)48-29-17-6-18-30-48/h1-48H;1-43H;1-44H;1-42H.
What are the key properties of 3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole?
3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole has a molecular weight of 3987.72 g/mol, XLogP of 68.90, 36 rotatable bonds, 0 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-[3,5-bis(1,3,5-triazin-2-yl)phenyl]-6-naphthalen-1-ylcarbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-ylcarbazole;9-(2,6-diphenylpyrimidin-4-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-naphthalen-2-ylcarbazol-3-yl]-6-naphthalen-2-ylcarbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-[9-(4,6-diphenylpyrimidin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenylcarbazol-3-yl]-6-phenylcarbazole is sourced from PubChem (CID 160598747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).