2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine

C34H25N3 — CID 175096751

IUPAC2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3C(c3ccccc3)c3ccccc3)n2)cc1
InChIInChI=1S/C34H25N3/c1-5-15-25(16-6-1)31(26-17-7-2-8-18-26)29-23-13-14-24-30(29)34-36-32(27-19-9-3-10-20-27)35-33(37-34)28-21-11-4-12-22-28/h1-24,31H
InChIKeyZFIAHGBWNMSDJK-UHFFFAOYSA-N
MW475.60 g/mol
LogP8.05
Rot. Bonds6

About 2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine

2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine (PubChem CID 175096751) has the molecular formula C34H25N3 and a molecular weight of 475.60 g/mol. Its IUPAC name is 2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine
PubChem CID175096751
Molecular FormulaC34H25N3
Molecular Weight475.60 g/mol
Exact Mass475.20
IUPAC Name2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3C(c3ccccc3)c3ccccc3)n2)cc1
InChIInChI=1S/C34H25N3/c1-5-15-25(16-6-1)31(26-17-7-2-8-18-26)29-23-13-14-24-30(29)34-36-32(27-19-9-3-10-20-27)35-33(37-34)28-21-11-4-12-22-28/h1-24,31H
InChIKeyZFIAHGBWNMSDJK-UHFFFAOYSA-N
XLogP8.05
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500475.60
LogP ≤ 58.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 129099147
2-[4-[4-(2-hydroxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol
CID 135975716
2-[6-[dibenzofuran-4-yl(phenyl)methyl]dibenzofuran-1-yl]-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine
CID 176818396
2-[4-[4-(2-hydroxyphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum
CID 135975715
2-(2,3-diphenylphenyl)-4,6-diphenyl-1,3,5-triazine
CID 171052479
2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenylphenyl]-4,6-diphenyl-1,3,5-triazine
CID 122423525
2-(2-chlorophenyl)-4-phenyl-6-(2-phenylphenyl)-1,3,5-triazine
CID 155151395
2-[3-[3-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-4,6-bis(2-phenylphenyl)-1,3,5-triazine;2-[3-[3-[3-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-4,6-bis(2-phenylphenyl)-1,3,5-triazine;2-[3-[3-[3-[3-[4,6-bis(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-4,6-bis(2-phenylphenyl)-1,3,5-triazine;2-phenyl-4-(2-phenylphenyl)-6-[3-[3-[3-[3-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(2-phenylphenyl)-6-[3-[3-[3-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(2-phenylphenyl)-6-[3-[3-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-1,3,5-triazine
CID 165007118
2-(2-bromophenyl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 155151393
2-naphthalen-1-yl-4-(5-naphthalen-1-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine
CID 168731887
2-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenol;ethane
CID 136651088
2-(4-phenylphenyl)-4-[2-(4-phenylphenyl)phenyl]-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine
CID 171052368

Frequently Asked Questions

What is the IUPAC name of 2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine?
The IUPAC name of 2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine (CID 175096751) is 2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine.
What is the SMILES notation for 2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine?
The canonical SMILES for 2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine is c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3C(c3ccccc3)c3ccccc3)n2)cc1.
What is the InChIKey of 2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine?
The InChIKey is ZFIAHGBWNMSDJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H25N3/c1-5-15-25(16-6-1)31(26-17-7-2-8-18-26)29-23-13-14-24-30(29)34-36-32(27-19-9-3-10-20-27)35-33(37-34)28-21-11-4-12-22-28/h1-24,31H.
What are the key properties of 2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine?
2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine has a molecular weight of 475.60 g/mol, XLogP of 8.05, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-benzhydrylphenyl)-4,6-diphenyl-1,3,5-triazine is sourced from PubChem (CID 175096751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).