2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine

C133H88N10 — CID 158038304

IUPAC2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4cccc(-c5ccccn5)c4)nc(-c4cccc(-c5ccccn5)c4)n3)c2)cc1.c1ccc(-c2ccc(-c3cc(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)cc(-c4ccccn4)c3)nc2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)nc(-c4ccc5ccccc5c4)n3)cc2)cc1
InChIInChI=1S/C51H32N2.C43H29N5.C39H27N3/c1-2-12-33(13-3-1)35-22-25-36(26-23-35)48-32-49(53-50(52-48)39-27-24-34-14-4-5-15-37(34)30-39)38-28-29-43-42-18-8-11-21-46(42)51(47(43)31-38)44-19-9-6-16-40(44)41-17-7-10-20-45(41)51;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;1-4-12-28(13-5-1)31-19-20-37(41-27-31)35-23-32(22-34(24-35)36-18-10-11-21-40-36)33-25-38(29-14-6-2-7-15-29)42-39(26-33)30-16-8-3-9-17-30/h1-32H;1-29H;1-27H
InChIKeyFIAQOVKSOYWSIR-UHFFFAOYSA-N
MW1826.24 g/mol
LogP32.85
Rot. Bonds17

About 2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine

2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine (PubChem CID 158038304) has the molecular formula C133H88N10 and a molecular weight of 1826.24 g/mol. Its IUPAC name is 2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine.

Molecular Properties

Compound Name2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine
PubChem CID158038304
Molecular FormulaC133H88N10
Molecular Weight1826.24 g/mol
Exact Mass1824.72
IUPAC Name2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4cccc(-c5ccccn5)c4)nc(-c4cccc(-c5ccccn5)c4)n3)c2)cc1.c1ccc(-c2ccc(-c3cc(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)cc(-c4ccccn4)c3)nc2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)nc(-c4ccc5ccccc5c4)n3)cc2)cc1
InChIInChI=1S/C51H32N2.C43H29N5.C39H27N3/c1-2-12-33(13-3-1)35-22-25-36(26-23-35)48-32-49(53-50(52-48)39-27-24-34-14-4-5-15-37(34)30-39)38-28-29-43-42-18-8-11-21-46(42)51(47(43)31-38)44-19-9-6-16-40(44)41-17-7-10-20-45(41)51;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;1-4-12-28(13-5-1)31-19-20-37(41-27-31)35-23-32(22-34(24-35)36-18-10-11-21-40-36)33-25-38(29-14-6-2-7-15-29)42-39(26-33)30-16-8-3-9-17-30/h1-32H;1-29H;1-27H
InChIKeyFIAQOVKSOYWSIR-UHFFFAOYSA-N
XLogP32.85
TPSA128.90 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds17
Heavy Atoms143
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001826.24
LogP ≤ 532.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine with MolForge

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Related Compounds

4-phenyl-2-(3-pyridin-2-ylphenyl)-6-[3-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrimidine
CID 167177109
2-(4-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine
CID 146631999
2-phenyl-4-[3-[6-[4-[4-(3-pyridin-2-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl]phenyl]-3-pyridinyl]phenyl]-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazine
CID 139307625
2-phenyl-4-(6-phenyl-3-pyridinyl)-6-[3-[3-(9,9'-spirobi[fluorene]-2-yl)phenyl]phenyl]pyrimidine
CID 146632584
2-naphthalen-2-yl-4-phenyl-6-[3-phenyl-5-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine
CID 171592063
4-[3-[3-(3'-naphthalen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenyl]phenyl]-2,6-diphenylpyrimidine;2-[3-[3-(3'-naphthalen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenyl]phenyl]-4-phenyl-6-(3-phenylphenyl)pyrimidine;2-[3-[3-(3'-naphthalen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenyl]phenyl]-4-phenyl-6-(4-phenylphenyl)pyrimidine
CID 158657443
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
4-(9,9-dimethylfluoren-2-yl)-2-(3-phenylphenyl)-6-(6-phenyl-3-pyridinyl)pyrimidine;4-(9,9-diphenylfluoren-2-yl)-2-(3-phenylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine
CID 162175263
2-[3-[7'-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 58943557
2-naphthalen-2-yl-4-phenyl-6-[3-phenyl-5-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine
CID 122543044
2-(3-phenylphenyl)-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine
CID 146632493
4-phenyl-2-(3-pyridin-2-ylphenyl)-6-(9,9'-spirobi[fluorene]-4'-yl)pyrimidine
CID 167177836

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine?
The IUPAC name of 2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine (CID 158038304) is 2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine.
What is the SMILES notation for 2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine?
The canonical SMILES for 2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine is c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4cccc(-c5ccccn5)c4)nc(-c4cccc(-c5ccccn5)c4)n3)c2)cc1.c1ccc(-c2ccc(-c3cc(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)cc(-c4ccccn4)c3)nc2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)nc(-c4ccc5ccccc5c4)n3)cc2)cc1.
What is the InChIKey of 2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine?
The InChIKey is FIAQOVKSOYWSIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H32N2.C43H29N5.C39H27N3/c1-2-12-33(13-3-1)35-22-25-36(26-23-35)48-32-49(53-50(52-48)39-27-24-34-14-4-5-15-37(34)30-39)38-28-29-43-42-18-8-11-21-46(42)51(47(43)31-38)44-19-9-6-16-40(44)41-17-7-10-20-45(41)51;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;1-4-12-28(13-5-1)31-19-20-37(41-27-31)35-23-32(22-34(24-35)36-18-10-11-21-40-36)33-25-38(29-14-6-2-7-15-29)42-39(26-33)30-16-8-3-9-17-30/h1-32H;1-29H;1-27H.
What are the key properties of 2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine?
2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine has a molecular weight of 1826.24 g/mol, XLogP of 32.85, 17 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-diphenylphenyl)-4,6-bis(3-pyridin-2-ylphenyl)-1,3,5-triazine;2,6-diphenyl-4-[3-(5-phenyl-2-pyridinyl)-5-pyridin-2-ylphenyl]pyridine;2-naphthalen-2-yl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)pyrimidine is sourced from PubChem (CID 158038304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).