2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine

C127H94N14 — CID 162051408

IUPAC2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine
SMILESCc1ccc(-c2nc(-c3ccc4ccccc4c3)cc(-c3ccc4ccccc4c3)n2)cc1.Cc1nc(-c2ccc(-c3ccccc3)cc2)nc(-c2ccc(-c3ccccc3)cc2)n1.Cc1nc(-c2cccc(-c3ccccc3)c2)nc(-c2cccc(-c3ccccc3)c2)n1.Cc1nc(-c2cccc3ccccc23)nc(-c2cccc3ccccc23)n1.Cc1nc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C31H22N2.2C28H21N3.C24H17N3.C16H13N3/c1-21-10-12-24(13-11-21)31-32-29(27-16-14-22-6-2-4-8-25(22)18-27)20-30(33-31)28-17-15-23-7-3-5-9-26(23)19-28;1-20-29-27(25-16-8-14-23(18-25)21-10-4-2-5-11-21)31-28(30-20)26-17-9-15-24(19-26)22-12-6-3-7-13-22;1-20-29-27(25-16-12-23(13-17-25)21-8-4-2-5-9-21)31-28(30-20)26-18-14-24(15-19-26)22-10-6-3-7-11-22;1-16-25-23(21-14-6-10-17-8-2-4-12-19(17)21)27-24(26-16)22-15-7-11-18-9-3-5-13-20(18)22;1-12-17-15(13-8-4-2-5-9-13)19-16(18-12)14-10-6-3-7-11-14/h2-20H,1H3;2*2-19H,1H3;2-15H,1H3;2-11H,1H3
InChIKeyYYPBXDICLBHOOP-UHFFFAOYSA-N
MW1816.25 g/mol
LogP31.12
Rot. Bonds15

About 2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine

2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine (PubChem CID 162051408) has the molecular formula C127H94N14 and a molecular weight of 1816.25 g/mol. Its IUPAC name is 2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine.

Molecular Properties

Compound Name2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine
PubChem CID162051408
Molecular FormulaC127H94N14
Molecular Weight1816.25 g/mol
Exact Mass1814.78
IUPAC Name2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine
SMILESCc1ccc(-c2nc(-c3ccc4ccccc4c3)cc(-c3ccc4ccccc4c3)n2)cc1.Cc1nc(-c2ccc(-c3ccccc3)cc2)nc(-c2ccc(-c3ccccc3)cc2)n1.Cc1nc(-c2cccc(-c3ccccc3)c2)nc(-c2cccc(-c3ccccc3)c2)n1.Cc1nc(-c2cccc3ccccc23)nc(-c2cccc3ccccc23)n1.Cc1nc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C31H22N2.2C28H21N3.C24H17N3.C16H13N3/c1-21-10-12-24(13-11-21)31-32-29(27-16-14-22-6-2-4-8-25(22)18-27)20-30(33-31)28-17-15-23-7-3-5-9-26(23)19-28;1-20-29-27(25-16-8-14-23(18-25)21-10-4-2-5-11-21)31-28(30-20)26-17-9-15-24(19-26)22-12-6-3-7-13-22;1-20-29-27(25-16-12-23(13-17-25)21-8-4-2-5-9-21)31-28(30-20)26-18-14-24(15-19-26)22-10-6-3-7-11-22;1-16-25-23(21-14-6-10-17-8-2-4-12-19(17)21)27-24(26-16)22-15-7-11-18-9-3-5-13-20(18)22;1-12-17-15(13-8-4-2-5-9-13)19-16(18-12)14-10-6-3-7-11-14/h2-20H,1H3;2*2-19H,1H3;2-15H,1H3;2-11H,1H3
InChIKeyYYPBXDICLBHOOP-UHFFFAOYSA-N
XLogP31.12
TPSA180.46 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds15
Heavy Atoms141
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001816.25
LogP ≤ 531.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine with MolForge

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Related Compounds

2-[3-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;bis(2-[3-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine);2-[3-[4-(6-naphthalen-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 163499320
2-naphthalen-1-yl-4-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazine
CID 165098602
2,4-dinaphthalen-1-yl-6-[3-(6-phenylnaphthalen-2-yl)phenyl]-1,3,5-triazine
CID 171598334
2-[3-(4-methylphenyl)-5-naphthalen-1-ylphenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(4-methylphenyl)-5-naphthalen-2-ylphenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(4-methylphenyl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(4-methylphenyl)-5-(4-phenylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 162132064
2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine
CID 155603318
2-[3-[5-[3-(4,6-diphenyl-2-pyridinyl)phenyl]naphthalen-2-yl]phenyl]-4,6-diphenylpyridine;2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-4,6-diphenyl-1,3,5-triazine;2-naphthalen-1-yl-4-[5-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-[5-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-6-phenyl-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[5-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3,5-triazine
CID 158729829
2,4-dinaphthalen-1-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2,4-dinaphthalen-1-yl-6-(4-naphthalen-2-ylphenyl)-1,3,5-triazine;2,4-dinaphthalen-1-yl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine;2,4-dinaphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4-naphthalen-2-yl-6-(3-naphthalen-2-ylphenyl)-1,3,5-triazine;2-naphthalen-2-yl-4-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 165099696
2,4-diphenyl-6-[4-[6-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]naphthalen-1-yl]phenyl]-1,3,5-triazine;2-[3-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-2-yl]phenyl]-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;2-[3-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-2-yl]phenyl]-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine
CID 160754470
2-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine;2-naphthalen-1-yl-4-[7-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-[7-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-6-phenyl-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]-1,3,5-triazine
CID 162157142
2-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-(5-phenylnaphthalen-1-yl)-6-(6-phenylnaphthalen-2-yl)-1,3,5-triazine
CID 169302511
2-naphthalen-1-yl-4,6-bis(4-naphthalen-2-ylphenyl)-1,3,5-triazine
CID 167133977
2-naphthalen-1-yl-4-[3-(2-naphthalen-2-yl-4-phenylphenyl)phenyl]-6-phenyl-1,3,5-triazine
CID 169297170

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine?
The IUPAC name of 2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine (CID 162051408) is 2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine.
What is the SMILES notation for 2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine?
The canonical SMILES for 2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine is Cc1ccc(-c2nc(-c3ccc4ccccc4c3)cc(-c3ccc4ccccc4c3)n2)cc1.Cc1nc(-c2ccc(-c3ccccc3)cc2)nc(-c2ccc(-c3ccccc3)cc2)n1.Cc1nc(-c2cccc(-c3ccccc3)c2)nc(-c2cccc(-c3ccccc3)c2)n1.Cc1nc(-c2cccc3ccccc23)nc(-c2cccc3ccccc23)n1.Cc1nc(-c2ccccc2)nc(-c2ccccc2)n1.
What is the InChIKey of 2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine?
The InChIKey is YYPBXDICLBHOOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H22N2.2C28H21N3.C24H17N3.C16H13N3/c1-21-10-12-24(13-11-21)31-32-29(27-16-14-22-6-2-4-8-25(22)18-27)20-30(33-31)28-17-15-23-7-3-5-9-26(23)19-28;1-20-29-27(25-16-8-14-23(18-25)21-10-4-2-5-11-21)31-28(30-20)26-17-9-15-24(19-26)22-12-6-3-7-13-22;1-20-29-27(25-16-12-23(13-17-25)21-8-4-2-5-9-21)31-28(30-20)26-18-14-24(15-19-26)22-10-6-3-7-11-22;1-16-25-23(21-14-6-10-17-8-2-4-12-19(17)21)27-24(26-16)22-15-7-11-18-9-3-5-13-20(18)22;1-12-17-15(13-8-4-2-5-9-13)19-16(18-12)14-10-6-3-7-11-14/h2-20H,1H3;2*2-19H,1H3;2-15H,1H3;2-11H,1H3.
What are the key properties of 2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine?
2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine has a molecular weight of 1816.25 g/mol, XLogP of 31.12, 15 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-dinaphthalen-1-yl-1,3,5-triazine;2-methyl-4,6-diphenyl-1,3,5-triazine;2-(4-methylphenyl)-4,6-dinaphthalen-2-ylpyrimidine is sourced from PubChem (CID 162051408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).