2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine

C92H63Br2N11 — CID 159330805

IUPAC2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine
SMILESBrc1cc(Br)cc(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)c1.Cc1cc(-c2ccccn2)cc(-c2ccccn2)c1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cc(-c5ccccn5)cc(-c5ccccn5)c4)cc(-c4cc(-c5ccccn5)cc(-c5ccccn5)c4)c3)n2)cc1
InChIInChI=1S/C53H35N7.C22H14Br2N2.C17H14N2/c1-3-15-36(16-4-1)51-58-52(37-17-5-2-6-18-37)60-53(59-51)46-32-38(40-28-42(47-19-7-11-23-54-47)34-43(29-40)48-20-8-12-24-55-48)27-39(33-46)41-30-44(49-21-9-13-25-56-49)35-45(31-41)50-22-10-14-26-57-50;23-18-11-17(12-19(24)13-18)22-25-20(15-7-3-1-4-8-15)14-21(26-22)16-9-5-2-6-10-16;1-13-10-14(16-6-2-4-8-18-16)12-15(11-13)17-7-3-5-9-19-17/h1-35H;1-14H;2-12H,1H3
InChIKeyLEYJJEHNAIMUIZ-UHFFFAOYSA-N
MW1482.40 g/mol
LogP23.58
Rot. Bonds14

About 2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine

2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine (PubChem CID 159330805) has the molecular formula C92H63Br2N11 and a molecular weight of 1482.40 g/mol. Its IUPAC name is 2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine.

Molecular Properties

Compound Name2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine
PubChem CID159330805
Molecular FormulaC92H63Br2N11
Molecular Weight1482.40 g/mol
Exact Mass1479.36
IUPAC Name2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine
SMILESBrc1cc(Br)cc(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)c1.Cc1cc(-c2ccccn2)cc(-c2ccccn2)c1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cc(-c5ccccn5)cc(-c5ccccn5)c4)cc(-c4cc(-c5ccccn5)cc(-c5ccccn5)c4)c3)n2)cc1
InChIInChI=1S/C53H35N7.C22H14Br2N2.C17H14N2/c1-3-15-36(16-4-1)51-58-52(37-17-5-2-6-18-37)60-53(59-51)46-32-38(40-28-42(47-19-7-11-23-54-47)34-43(29-40)48-20-8-12-24-55-48)27-39(33-46)41-30-44(49-21-9-13-25-56-49)35-45(31-41)50-22-10-14-26-57-50;23-18-11-17(12-19(24)13-18)22-25-20(15-7-3-1-4-8-15)14-21(26-22)16-9-5-2-6-10-16;1-13-10-14(16-6-2-4-8-18-16)12-15(11-13)17-7-3-5-9-19-17/h1-35H;1-14H;2-12H,1H3
InChIKeyLEYJJEHNAIMUIZ-UHFFFAOYSA-N
XLogP23.58
TPSA141.79 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds14
Heavy Atoms105
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001482.40
LogP ≤ 523.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine with MolForge

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Related Compounds

2-phenyl-4,6-bis[3-phenyl-5-(4-pyridin-2-ylphenyl)phenyl]pyrimidine
CID 134166118
2-methyl-4-phenyl-6-(3-phenyl-5-pyridin-2-ylphenyl)-1,3,5-triazine
CID 146568414
4,6-diphenyl-2-[3-(4-phenylphenyl)-5-(4-pyridin-2-ylphenyl)phenyl]pyrimidine
CID 122549117
2,4-diphenyl-6-[3-phenyl-5-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine
CID 59510699
4-(3-bromo-5-phenylphenyl)-2,6-diphenylpyrimidine
CID 58943669
4,6-diphenyl-2-[3-(4-pyridin-2-ylphenyl)-5-(4-pyrimidin-2-ylphenyl)phenyl]pyrimidine
CID 129292650
2-(3,5-dipyridin-2-ylphenyl)-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine
CID 118582359
2-[3-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 126730905
2-[3-[3-(3,5-dipyridin-2-ylphenyl)-5-methylphenyl]-5-pyridin-2-ylphenyl]pyridine
CID 58556429
4,6-diphenyl-2-pyridin-2-ylpyrimidine;ethane
CID 145283767
2,4-diphenyl-6-pyridin-2-ylpyrimidine
CID 126746872
2-[3-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-5-pyridin-2-ylphenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 126730883

Frequently Asked Questions

What is the IUPAC name of 2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine?
The IUPAC name of 2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine (CID 159330805) is 2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine.
What is the SMILES notation for 2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine?
The canonical SMILES for 2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine is Brc1cc(Br)cc(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)c1.Cc1cc(-c2ccccn2)cc(-c2ccccn2)c1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cc(-c5ccccn5)cc(-c5ccccn5)c4)cc(-c4cc(-c5ccccn5)cc(-c5ccccn5)c4)c3)n2)cc1.
What is the InChIKey of 2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine?
The InChIKey is LEYJJEHNAIMUIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H35N7.C22H14Br2N2.C17H14N2/c1-3-15-36(16-4-1)51-58-52(37-17-5-2-6-18-37)60-53(59-51)46-32-38(40-28-42(47-19-7-11-23-54-47)34-43(29-40)48-20-8-12-24-55-48)27-39(33-46)41-30-44(49-21-9-13-25-56-49)35-45(31-41)50-22-10-14-26-57-50;23-18-11-17(12-19(24)13-18)22-25-20(15-7-3-1-4-8-15)14-21(26-22)16-9-5-2-6-10-16;1-13-10-14(16-6-2-4-8-18-16)12-15(11-13)17-7-3-5-9-19-17/h1-35H;1-14H;2-12H,1H3.
What are the key properties of 2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine?
2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine has a molecular weight of 1482.40 g/mol, XLogP of 23.58, 14 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3,5-bis(3,5-dipyridin-2-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3,5-dibromophenyl)-4,6-diphenylpyrimidine;2-(3-methyl-5-pyridin-2-ylphenyl)pyridine is sourced from PubChem (CID 159330805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).