2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine

C270H178N28 — CID 159224759

IUPAC2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4cccc(-c5ccccn5)c4)nc(-c4cccc(-c5ccccn5)c4)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4cccc(-c5ncccn5)c4)cc(-c4cccc(-c5ncccn5)c4)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3cc(-c4cccc5ncccc45)cc(-c4cc5ccccc5c5ccccc45)c3)n2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)nc4)cc(-c4nc(-c5cccc6ccccc56)nc(-c5cccc6ccccc56)n4)c3)cn2)cc1.c1ccc(-c2cccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4cc(-c5cccnc5)cc(-c5cccnc5)c4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cccc(-c5ccncc5)c4)cc(-c4cc5ccccc5c5ccccc45)c3)n2)cc1
InChIInChI=1S/C51H33N5.C46H30N4.C45H29N3.2C43H29N5.C42H28N6/c1-3-15-36(16-4-1)47-27-25-38(32-52-47)40-29-41(39-26-28-48(53-33-39)37-17-5-2-6-18-37)31-42(30-40)49-54-50(45-23-11-19-34-13-7-9-21-43(34)45)56-51(55-49)46-24-12-20-35-14-8-10-22-44(35)46;1-3-12-32(13-4-1)44-48-45(33-14-5-2-6-15-33)50-46(49-44)39-28-37(35-18-11-17-34(26-35)31-22-24-47-25-23-31)27-38(29-39)43-30-36-16-7-8-19-40(36)41-20-9-10-21-42(41)43;1-3-13-30(14-4-1)43-29-44(31-15-5-2-6-16-31)48-45(47-43)35-26-33(37-21-11-23-42-40(37)22-12-24-46-42)25-34(27-35)41-28-32-17-7-8-18-36(32)38-19-9-10-20-39(38)41;1-3-11-30(12-4-1)32-15-7-17-34(23-32)41-46-42(35-18-8-16-33(24-35)31-13-5-2-6-14-31)48-43(47-41)40-26-38(36-19-9-21-44-28-36)25-39(27-40)37-20-10-22-45-29-37;1-3-13-30(14-4-1)36-27-37(31-15-5-2-6-16-31)29-38(28-36)43-47-41(34-19-11-17-32(25-34)39-21-7-9-23-44-39)46-42(48-43)35-20-12-18-33(26-35)40-22-8-10-24-45-40;1-3-11-29(12-4-1)35-25-36(30-13-5-2-6-14-30)27-37(26-35)42-47-38(31-15-7-17-33(23-31)40-43-19-9-20-44-40)28-39(48-42)32-16-8-18-34(24-32)41-45-21-10-22-46-41/h1-33H;1-30H;3*1-29H;1-28H
InChIKeyKSDLXBQCZHUPRV-UHFFFAOYSA-N
MW3814.59 g/mol
LogP66.26
Rot. Bonds39

About 2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine

2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine (PubChem CID 159224759) has the molecular formula C270H178N28 and a molecular weight of 3814.59 g/mol. Its IUPAC name is 2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine
PubChem CID159224759
Molecular FormulaC270H178N28
Molecular Weight3814.59 g/mol
Exact Mass3811.48
IUPAC Name2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4cccc(-c5ccccn5)c4)nc(-c4cccc(-c5ccccn5)c4)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4cccc(-c5ncccn5)c4)cc(-c4cccc(-c5ncccn5)c4)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3cc(-c4cccc5ncccc45)cc(-c4cc5ccccc5c5ccccc45)c3)n2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)nc4)cc(-c4nc(-c5cccc6ccccc56)nc(-c5cccc6ccccc56)n4)c3)cn2)cc1.c1ccc(-c2cccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4cc(-c5cccnc5)cc(-c5cccnc5)c4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cccc(-c5ccncc5)c4)cc(-c4cc5ccccc5c5ccccc45)c3)n2)cc1
InChIInChI=1S/C51H33N5.C46H30N4.C45H29N3.2C43H29N5.C42H28N6/c1-3-15-36(16-4-1)47-27-25-38(32-52-47)40-29-41(39-26-28-48(53-33-39)37-17-5-2-6-18-37)31-42(30-40)49-54-50(45-23-11-19-34-13-7-9-21-43(34)45)56-51(55-49)46-24-12-20-35-14-8-10-22-44(35)46;1-3-12-32(13-4-1)44-48-45(33-14-5-2-6-15-33)50-46(49-44)39-28-37(35-18-11-17-34(26-35)31-22-24-47-25-23-31)27-38(29-39)43-30-36-16-7-8-19-40(36)41-20-9-10-21-42(41)43;1-3-13-30(14-4-1)43-29-44(31-15-5-2-6-16-31)48-45(47-43)35-26-33(37-21-11-23-42-40(37)22-12-24-46-42)25-34(27-35)41-28-32-17-7-8-18-36(32)38-19-9-10-20-39(38)41;1-3-11-30(12-4-1)32-15-7-17-34(23-32)41-46-42(35-18-8-16-33(24-35)31-13-5-2-6-14-31)48-43(47-41)40-26-38(36-19-9-21-44-28-36)25-39(27-40)37-20-10-22-45-29-37;1-3-13-30(14-4-1)36-27-37(31-15-5-2-6-16-31)29-38(28-36)43-47-41(34-19-11-17-32(25-34)39-21-7-9-23-44-39)46-42(48-43)35-20-12-18-33(26-35)40-22-8-10-24-45-40;1-3-11-29(12-4-1)35-25-36(30-13-5-2-6-14-30)27-37(26-35)42-47-38(31-15-7-17-33(23-31)40-43-19-9-20-44-40)28-39(48-42)32-16-8-18-34(24-32)41-45-21-10-22-46-41/h1-33H;1-30H;3*1-29H;1-28H
InChIKeyKSDLXBQCZHUPRV-UHFFFAOYSA-N
XLogP66.26
TPSA360.92 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds39
Heavy Atoms298
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003814.59
LogP ≤ 566.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

Analyze 2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine with MolForge

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Related Compounds

5-[4-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-6-quinolin-5-yl-1,3,5-triazin-2-yl]quinoline;5-[4-[6-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-6-quinolin-5-yl-1,3,5-triazin-2-yl]quinoline;5-[4-[6-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-6-quinolin-5-yl-1,3,5-triazin-2-yl]quinoline;5-[4-(5-phenyl-2-pyridinyl)-6-[6-[4-(4-pyridin-2-ylphenyl)-6-quinolin-5-yl-1,3,5-triazin-2-yl]pyren-1-yl]-1,3,5-triazin-2-yl]quinoline;5-[4-(3-pyridin-2-ylphenyl)-6-[6-[4-(3-pyridin-2-ylphenyl)-6-quinolin-5-yl-1,3,5-triazin-2-yl]pyren-1-yl]-1,3,5-triazin-2-yl]quinoline;5-[4-(3-pyridin-3-ylphenyl)-6-[6-[4-(3-pyridin-3-ylphenyl)-6-quinolin-5-yl-1,3,5-triazin-2-yl]pyren-1-yl]-1,3,5-triazin-2-yl]quinoline;5-[4-(3-pyridin-4-ylphenyl)-6-[6-[4-(3-pyridin-4-ylphenyl)-6-quinolin-5-yl-1,3,5-triazin-2-yl]pyren-1-yl]-1,3,5-triazin-2-yl]quinoline;5-[4-(4-pyridin-4-ylphenyl)-6-[6-[4-(4-pyridin-4-ylphenyl)-6-quinolin-5-yl-1,3,5-triazin-2-yl]pyren-1-yl]-1,3,5-triazin-2-yl]quinoline
CID 158617084
2,4-dinaphthalen-1-yl-6-[3-phenanthren-9-yl-5-(6-pyridin-2-yl-3-pyridinyl)phenyl]-1,3,5-triazine
CID 122416044
4-[3,5-bis(4-phenyl-2-pyridinyl)phenyl]-2,6-diphenylpyridine;2-(3,5-dinaphthalen-1-ylphenyl)-4,6-bis(4-pyridin-2-ylphenyl)pyrimidine;2,6-diphenyl-4-[3-phenyl-5-(5-phenyl-2-pyridinyl)phenyl]pyridine
CID 159726197
2,6-diphenyl-4-[3-phenyl-5-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]pyridine;4,6-diphenyl-2-[3-phenyl-5-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]pyrimidine;2,4-diphenyl-6-[3-phenyl-5-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[2-(4-phenylphenyl)phenyl]phenyl]pyrimidine;4-phenyl-2,6-bis[2-(4-phenylphenyl)phenyl]pyrimidine;4-phenyl-2,6-bis[2-[3-(3-pyridin-2-ylphenyl)phenyl]phenyl]pyrimidine;2-[3-phenyl-5-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]-4,6-dipyridin-4-yl-1,3,5-triazine;2-[3-[3-phenyl-5-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]-5-pyridin-3-ylphenyl]pyridine;3-[3-[3-phenyl-5-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]-5-pyridin-3-ylphenyl]pyridine;4-[3-[3-phenyl-5-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]-5-pyridin-4-ylphenyl]pyridine
CID 167658197
2,4-bis(4-naphthalen-1-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-(4-phenanthren-9-ylphenyl)-2-(4-phenylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine
CID 160517437
2,4-bis[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine
CID 165068322
2,6-diphenyl-4-(4-phenylphenyl)pyridine;2,6-diphenyl-4-(4-pyridin-3-ylphenyl)pyridine;5-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]isoquinoline;5-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]quinoline
CID 160905421
5-[3-bromo-5-[2-(4-pyridin-3-ylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidin-4-yl]phenyl]quinoline
CID 155195979
2,6-diphenyl-4-triphenylen-2-ylpyridine;4,6-diphenyl-2-triphenylen-2-ylpyrimidine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;2-phenyl-4-pyridin-4-yl-6-triphenylen-2-yl-1,3,5-triazine;4-(3-phenyl-5-triphenylen-2-ylphenyl)pyridine;2-phenyl-4-triphenylen-2-ylpyrimidine;2-(3-pyridin-2-yl-5-triphenylen-2-ylphenyl)pyridine;2-(3-pyridin-3-yl-5-triphenylen-2-ylphenyl)pyridine;4-(3-pyridin-4-yl-5-triphenylen-2-ylphenyl)pyridine;2-pyridin-4-yl-4-triphenylen-2-ylpyrimidine
CID 158935180
2-[3-phenanthren-2-yl-5-(4-pyridin-4-ylphenyl)phenyl]-4-(6-phenyl-3-pyridinyl)-6-(4-pyridin-2-ylphenyl)-1,3,5-triazine
CID 122416054
2,4-diphenyl-6-[3-(4-pyridin-3-ylnaphthalen-2-yl)phenyl]pyrimidine;2,4-diphenyl-6-[3-(4-pyridin-3-ylphenyl)phenyl]pyrimidine;2,4-diphenyl-6-[3-(4-pyridin-4-ylphenyl)phenyl]pyrimidine;2-phenyl-4-(3-phenylphenyl)-6-[3-(4-pyridin-4-ylphenyl)phenyl]pyrimidine;2-phenyl-4-(3-phenylphenyl)-6-[4-(3-pyridin-4-ylphenyl)phenyl]pyrimidine;2-phenyl-4-(4-phenylphenyl)-6-[3-(4-pyridin-3-ylphenyl)phenyl]pyrimidine
CID 167541800
2-(3-naphthalen-1-ylphenyl)-4-(4-phenanthren-9-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine
CID 121477588

Frequently Asked Questions

What is the IUPAC name of 2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine?
The IUPAC name of 2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine (CID 159224759) is 2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine.
What is the SMILES notation for 2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine?
The canonical SMILES for 2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine is c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4cccc(-c5ccccn5)c4)nc(-c4cccc(-c5ccccn5)c4)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4cccc(-c5ncccn5)c4)cc(-c4cccc(-c5ncccn5)c4)n3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3cc(-c4cccc5ncccc45)cc(-c4cc5ccccc5c5ccccc45)c3)n2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)nc4)cc(-c4nc(-c5cccc6ccccc56)nc(-c5cccc6ccccc56)n4)c3)cn2)cc1.c1ccc(-c2cccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4cc(-c5cccnc5)cc(-c5cccnc5)c4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cccc(-c5ccncc5)c4)cc(-c4cc5ccccc5c5ccccc45)c3)n2)cc1.
What is the InChIKey of 2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine?
The InChIKey is KSDLXBQCZHUPRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H33N5.C46H30N4.C45H29N3.2C43H29N5.C42H28N6/c1-3-15-36(16-4-1)47-27-25-38(32-52-47)40-29-41(39-26-28-48(53-33-39)37-17-5-2-6-18-37)31-42(30-40)49-54-50(45-23-11-19-34-13-7-9-21-43(34)45)56-51(55-49)46-24-12-20-35-14-8-10-22-44(35)46;1-3-12-32(13-4-1)44-48-45(33-14-5-2-6-15-33)50-46(49-44)39-28-37(35-18-11-17-34(26-35)31-22-24-47-25-23-31)27-38(29-39)43-30-36-16-7-8-19-40(36)41-20-9-10-21-42(41)43;1-3-13-30(14-4-1)43-29-44(31-15-5-2-6-16-31)48-45(47-43)35-26-33(37-21-11-23-42-40(37)22-12-24-46-42)25-34(27-35)41-28-32-17-7-8-18-36(32)38-19-9-10-20-39(38)41;1-3-11-30(12-4-1)32-15-7-17-34(23-32)41-46-42(35-18-8-16-33(24-35)31-13-5-2-6-14-31)48-43(47-41)40-26-38(36-19-9-21-44-28-36)25-39(27-40)37-20-10-22-45-29-37;1-3-13-30(14-4-1)36-27-37(31-15-5-2-6-16-31)29-38(28-36)43-47-41(34-19-11-17-32(25-34)39-21-7-9-23-44-39)46-42(48-43)35-20-12-18-33(26-35)40-22-8-10-24-45-40;1-3-11-29(12-4-1)35-25-36(30-13-5-2-6-14-30)27-37(26-35)42-47-38(31-15-7-17-33(23-31)40-43-19-9-20-44-40)28-39(48-42)32-16-8-18-34(24-32)41-45-21-10-22-46-41/h1-33H;1-30H;3*1-29H;1-28H.
What are the key properties of 2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine?
2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine has a molecular weight of 3814.59 g/mol, XLogP of 66.26, 39 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3,5-bis(6-phenyl-3-pyridinyl)phenyl]-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4,6-bis(3-pyrimidin-2-ylphenyl)pyrimidine;5-[3-(4,6-diphenylpyrimidin-2-yl)-5-phenanthren-9-ylphenyl]quinoline;2-(3,5-dipyridin-3-ylphenyl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-[3-phenanthren-9-yl-5-(3-pyridin-4-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine is sourced from PubChem (CID 159224759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).