2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine

C286H174N38 — CID 157197011

IUPAC2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine
SMILESc1ccc(-c2cc(-c3nc(-c4ccc(-c5ccccn5)cc4)nc(-c4ccc(-c5ccccn5)cc4)n3)c3ccc4c(-c5ccccc5)cc(-c5nc(-c6ccc(-c7ccccn7)cc6)nc(-c6ccc(-c7ccccn7)cc6)n5)c5ccc2c3c45)cc1.c1ccc(-c2nc(-c3ccc(-c4ccccn4)cc3)nc(-c3cc(-c4ccccc4)c4ccc5c(-c6nc(-c7ccccc7)nc(-c7ccc(-c8ccccn8)cc7)n6)cc(-c6ccccc6)c6ccc3c4c65)n2)cc1.c1ccc(-c2nc(-c3ccc4ncccc4c3)nc(-c3cc(-c4ccccc4)c4ccc5c(-c6nc(-c7ccccc7)nc(-c7ccc8ncccc8c7)n6)cc(-c6ccccc6)c6ccc3c4c65)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3nc(-c4ccccc4)nc(-c4cc(-c5ccccc5)c5ccc6c(-c7nc(-c8ccccc8)nc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)n7)cc(-c7ccccc7)c7ccc4c5c76)n3)n2)cc1
InChIInChI=1S/C78H48N10.C76H46N12.C68H42N8.C64H38N8/c1-3-15-49(16-4-1)63-47-65(77-85-73(55-31-23-51(24-32-55)67-19-7-11-43-79-67)83-74(86-77)56-33-25-52(26-34-56)68-20-8-12-44-80-68)61-42-40-60-64(50-17-5-2-6-18-50)48-66(62-41-39-59(63)71(61)72(60)62)78-87-75(57-35-27-53(28-36-57)69-21-9-13-45-81-69)84-76(88-78)58-37-29-54(30-38-58)70-22-10-14-46-82-70;1-9-25-47(26-10-1)59-45-61(71-79-69(53-37-21-7-22-38-53)85-75(87-71)73-81-65(49-29-13-3-14-30-49)77-66(82-73)50-31-15-4-16-32-50)57-44-42-56-60(48-27-11-2-12-28-48)46-62(58-43-41-55(59)63(57)64(56)58)72-80-70(54-39-23-8-24-40-54)86-76(88-72)74-83-67(51-33-17-5-18-34-51)78-68(84-74)52-35-19-6-20-36-52;1-5-17-43(18-6-1)55-41-57(67-73-63(47-21-9-3-10-22-47)71-65(75-67)49-31-27-45(28-32-49)59-25-13-15-39-69-59)53-38-36-52-56(44-19-7-2-8-20-44)42-58(54-37-35-51(55)61(53)62(52)54)68-74-64(48-23-11-4-12-24-48)72-66(76-68)50-33-29-46(30-34-50)60-26-14-16-40-70-60;1-5-15-39(16-6-1)51-37-53(63-69-59(41-19-9-3-10-20-41)67-61(71-63)45-25-31-55-43(35-45)23-13-33-65-55)49-30-28-48-52(40-17-7-2-8-18-40)38-54(50-29-27-47(51)57(49)58(48)50)64-70-60(42-21-11-4-12-22-42)68-62(72-64)46-26-32-56-44(36-46)24-14-34-66-56/h1-48H;1-46H;1-42H;1-38H
InChIKeyAQJCYCYRDQNJTR-UHFFFAOYSA-N
MW4142.80 g/mol
LogP67.67
Rot. Bonds42

About 2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine

2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine (PubChem CID 157197011) has the molecular formula C286H174N38 and a molecular weight of 4142.80 g/mol. Its IUPAC name is 2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine
PubChem CID157197011
Molecular FormulaC286H174N38
Molecular Weight4142.80 g/mol
Exact Mass4139.48
IUPAC Name2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine
SMILESc1ccc(-c2cc(-c3nc(-c4ccc(-c5ccccn5)cc4)nc(-c4ccc(-c5ccccn5)cc4)n3)c3ccc4c(-c5ccccc5)cc(-c5nc(-c6ccc(-c7ccccn7)cc6)nc(-c6ccc(-c7ccccn7)cc6)n5)c5ccc2c3c45)cc1.c1ccc(-c2nc(-c3ccc(-c4ccccn4)cc3)nc(-c3cc(-c4ccccc4)c4ccc5c(-c6nc(-c7ccccc7)nc(-c7ccc(-c8ccccn8)cc7)n6)cc(-c6ccccc6)c6ccc3c4c65)n2)cc1.c1ccc(-c2nc(-c3ccc4ncccc4c3)nc(-c3cc(-c4ccccc4)c4ccc5c(-c6nc(-c7ccccc7)nc(-c7ccc8ncccc8c7)n6)cc(-c6ccccc6)c6ccc3c4c65)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3nc(-c4ccccc4)nc(-c4cc(-c5ccccc5)c5ccc6c(-c7nc(-c8ccccc8)nc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)n7)cc(-c7ccccc7)c7ccc4c5c76)n3)n2)cc1
InChIInChI=1S/C78H48N10.C76H46N12.C68H42N8.C64H38N8/c1-3-15-49(16-4-1)63-47-65(77-85-73(55-31-23-51(24-32-55)67-19-7-11-43-79-67)83-74(86-77)56-33-25-52(26-34-56)68-20-8-12-44-80-68)61-42-40-60-64(50-17-5-2-6-18-50)48-66(62-41-39-59(63)71(61)72(60)62)78-87-75(57-35-27-53(28-36-57)69-21-9-13-45-81-69)84-76(88-78)58-37-29-54(30-38-58)70-22-10-14-46-82-70;1-9-25-47(26-10-1)59-45-61(71-79-69(53-37-21-7-22-38-53)85-75(87-71)73-81-65(49-29-13-3-14-30-49)77-66(82-73)50-31-15-4-16-32-50)57-44-42-56-60(48-27-11-2-12-28-48)46-62(58-43-41-55(59)63(57)64(56)58)72-80-70(54-39-23-8-24-40-54)86-76(88-72)74-83-67(51-33-17-5-18-34-51)78-68(84-74)52-35-19-6-20-36-52;1-5-17-43(18-6-1)55-41-57(67-73-63(47-21-9-3-10-22-47)71-65(75-67)49-31-27-45(28-32-49)59-25-13-15-39-69-59)53-38-36-52-56(44-19-7-2-8-20-44)42-58(54-37-35-51(55)61(53)62(52)54)68-74-64(48-23-11-4-12-24-48)72-66(76-68)50-33-29-46(30-34-50)60-26-14-16-40-70-60;1-5-15-39(16-6-1)51-37-53(63-69-59(41-19-9-3-10-20-41)67-61(71-63)45-25-31-55-43(35-45)23-13-33-65-55)49-30-28-48-52(40-17-7-2-8-18-40)38-54(50-29-27-47(51)57(49)58(48)50)64-70-60(42-21-11-4-12-22-42)68-62(72-64)46-26-32-56-44(36-46)24-14-34-66-56/h1-48H;1-46H;1-42H;1-38H
InChIKeyAQJCYCYRDQNJTR-UHFFFAOYSA-N
XLogP67.67
TPSA489.82 Ų
H-Bond Donors
H-Bond Acceptors38
Rotatable Bonds42
Heavy Atoms324
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004142.80
LogP ≤ 567.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1038

Analyze 2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine with MolForge

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Launch Full Analysis

Related Compounds

6-[4-[3,8-diphenyl-6-[4-(4-pyridin-3-ylphenyl)-6-quinolin-6-yl-1,3,5-triazin-2-yl]pyren-1-yl]-6-(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]quinoline
CID 146230638
7-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-7-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline
CID 146230629
6-[4-(4-pyridin-2-ylphenyl)-6-quinolin-6-yl-1,3,5-triazin-2-yl]quinoline
CID 122427591
6-[8-(4-pyridin-2-ylphenyl)pyren-1-yl]quinoline
CID 144554033
2-[4-[7-phenyl-3-(4-phenylphenyl)pyren-1-yl]phenyl]pyridine
CID 58028909
2-phenyl-4-(4-pyridin-2-ylphenyl)-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazine
CID 130265192
3-[4-[7-tert-butyl-3-(4-pyridin-2-ylphenyl)pyren-1-yl]phenyl]quinoline
CID 58028892
2-[4-[7-phenyl-3-(4-phenylphenyl)pyren-1-yl]phenyl]pyridine;3-[7-(4-phenylphenyl)-3-pyridin-3-ylpyren-1-yl]pyridine;3-[7-phenyl-3-(4-pyridin-3-ylphenyl)pyren-1-yl]pyridine
CID 157121203
6-[4-[4-[4-cyclohexa-1,5-dien-3-yn-1-yl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]quinoline
CID 154949161
6-[4-naphthalen-2-yl-6-[6-(4-naphthalen-2-yl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-1,3,5-triazin-2-yl]quinoline;6-[4-naphthalen-2-yl-6-[6-(4-naphthalen-2-yl-6-quinoxalin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-1,3,5-triazin-2-yl]quinoxaline;6-[4-quinolin-6-yl-6-[6-(4-quinolin-6-yl-6-quinoxalin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-1,3,5-triazin-2-yl]quinoxaline
CID 161318448
2-naphthalen-2-yl-4-phenyl-6-[3-phenyl-5-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine
CID 122543044
2-[6-(4,6-dipyridin-3-yl-1,3,5-triazin-2-yl)-3,8-diphenylpyren-1-yl]-4,6-dipyridin-3-yl-1,3,5-triazine
CID 146230581

Frequently Asked Questions

What is the IUPAC name of 2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine?
The IUPAC name of 2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine (CID 157197011) is 2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine.
What is the SMILES notation for 2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine?
The canonical SMILES for 2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine is c1ccc(-c2cc(-c3nc(-c4ccc(-c5ccccn5)cc4)nc(-c4ccc(-c5ccccn5)cc4)n3)c3ccc4c(-c5ccccc5)cc(-c5nc(-c6ccc(-c7ccccn7)cc6)nc(-c6ccc(-c7ccccn7)cc6)n5)c5ccc2c3c45)cc1.c1ccc(-c2nc(-c3ccc(-c4ccccn4)cc3)nc(-c3cc(-c4ccccc4)c4ccc5c(-c6nc(-c7ccccc7)nc(-c7ccc(-c8ccccn8)cc7)n6)cc(-c6ccccc6)c6ccc3c4c65)n2)cc1.c1ccc(-c2nc(-c3ccc4ncccc4c3)nc(-c3cc(-c4ccccc4)c4ccc5c(-c6nc(-c7ccccc7)nc(-c7ccc8ncccc8c7)n6)cc(-c6ccccc6)c6ccc3c4c65)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3nc(-c4ccccc4)nc(-c4cc(-c5ccccc5)c5ccc6c(-c7nc(-c8ccccc8)nc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)n7)cc(-c7ccccc7)c7ccc4c5c76)n3)n2)cc1.
What is the InChIKey of 2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine?
The InChIKey is AQJCYCYRDQNJTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C78H48N10.C76H46N12.C68H42N8.C64H38N8/c1-3-15-49(16-4-1)63-47-65(77-85-73(55-31-23-51(24-32-55)67-19-7-11-43-79-67)83-74(86-77)56-33-25-52(26-34-56)68-20-8-12-44-80-68)61-42-40-60-64(50-17-5-2-6-18-50)48-66(62-41-39-59(63)71(61)72(60)62)78-87-75(57-35-27-53(28-36-57)69-21-9-13-45-81-69)84-76(88-78)58-37-29-54(30-38-58)70-22-10-14-46-82-70;1-9-25-47(26-10-1)59-45-61(71-79-69(53-37-21-7-22-38-53)85-75(87-71)73-81-65(49-29-13-3-14-30-49)77-66(82-73)50-31-15-4-16-32-50)57-44-42-56-60(48-27-11-2-12-28-48)46-62(58-43-41-55(59)63(57)64(56)58)72-80-70(54-39-23-8-24-40-54)86-76(88-72)74-83-67(51-33-17-5-18-34-51)78-68(84-74)52-35-19-6-20-36-52;1-5-17-43(18-6-1)55-41-57(67-73-63(47-21-9-3-10-22-47)71-65(75-67)49-31-27-45(28-32-49)59-25-13-15-39-69-59)53-38-36-52-56(44-19-7-2-8-20-44)42-58(54-37-35-51(55)61(53)62(52)54)68-74-64(48-23-11-4-12-24-48)72-66(76-68)50-33-29-46(30-34-50)60-26-14-16-40-70-60;1-5-15-39(16-6-1)51-37-53(63-69-59(41-19-9-3-10-20-41)67-61(71-63)45-25-31-55-43(35-45)23-13-33-65-55)49-30-28-48-52(40-17-7-2-8-18-40)38-54(50-29-27-47(51)57(49)58(48)50)64-70-60(42-21-11-4-12-22-42)68-62(72-64)46-26-32-56-44(36-46)24-14-34-66-56/h1-48H;1-46H;1-42H;1-38H.
What are the key properties of 2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine?
2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine has a molecular weight of 4142.80 g/mol, XLogP of 67.67, 42 rotatable bonds, 0 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,8-diphenyl-6-[4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-4-phenyl-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine;6-[4-[3,8-diphenyl-6-(4-phenyl-6-quinolin-6-yl-1,3,5-triazin-2-yl)pyren-1-yl]-6-phenyl-1,3,5-triazin-2-yl]quinoline;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-3,8-diphenylpyren-1-yl]-6-phenyl-1,3,5-triazine is sourced from PubChem (CID 157197011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).