2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine

C31H21N3 — CID 163794965

IUPAC2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccc5ccccc5c4)n3)c2)cc1
InChIInChI=1S/C31H21N3/c1-3-10-22(11-4-1)26-16-9-17-27(20-26)30-32-29(24-13-5-2-6-14-24)33-31(34-30)28-19-18-23-12-7-8-15-25(23)21-28/h1-21H
InChIKeyCDYXWAANZAGCCJ-UHFFFAOYSA-N
MW435.53 g/mol
LogP7.69
Rot. Bonds4

About 2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine

2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine (PubChem CID 163794965) has the molecular formula C31H21N3 and a molecular weight of 435.53 g/mol. Its IUPAC name is 2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
PubChem CID163794965
Molecular FormulaC31H21N3
Molecular Weight435.53 g/mol
Exact Mass435.17
IUPAC Name2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccc5ccccc5c4)n3)c2)cc1
InChIInChI=1S/C31H21N3/c1-3-10-22(11-4-1)26-16-9-17-27(20-26)30-32-29(24-13-5-2-6-14-24)33-31(34-30)28-19-18-23-12-7-8-15-25(23)21-28/h1-21H
InChIKeyCDYXWAANZAGCCJ-UHFFFAOYSA-N
XLogP7.69
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500435.53
LogP ≤ 57.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-(4-naphthalen-2-ylphenyl)-6-phenyl-1,3,5-triazine
CID 154626597
2,4-dinaphthalen-2-yl-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine
CID 154589115
2-naphthalen-2-yl-4-phenyl-6-[3-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]-1,3,5-triazine
CID 122606651
2-[3-[3-[3-(3-naphthalen-2-yl-5-phenylphenyl)phenyl]phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 121311605
2,4-dinaphthalen-2-yl-6-[6-[3-(3-phenylphenyl)phenyl]naphthalen-2-yl]-1,3,5-triazine
CID 164745871
2-[3-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 139339089
2-(4-naphthalen-2-ylphenyl)-4-phenyl-6-(6-phenylnaphthalen-2-yl)-1,3,5-triazine
CID 170180018
2,4-bis(3,5-diphenylphenyl)-6-naphthalen-2-yl-1,3,5-triazine;2-[3,5-bis(4-naphthalen-2-ylphenyl)phenyl]naphthalene;2-naphthalen-2-yl-4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazine
CID 163792749
2,4-bis(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 153292216
2-naphthalen-2-yl-4-(7-naphthalen-2-ylnaphthalen-2-yl)-6-(6-phenylnaphthalen-2-yl)-1,3,5-triazine
CID 176588187
2-[4-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine
CID 163413584
2-[3-[6-(2-naphthalen-2-ylphenyl)naphthalen-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 174244505

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine?
The IUPAC name of 2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine (CID 163794965) is 2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine.
What is the SMILES notation for 2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine?
The canonical SMILES for 2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine is c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccc5ccccc5c4)n3)c2)cc1.
What is the InChIKey of 2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine?
The InChIKey is CDYXWAANZAGCCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H21N3/c1-3-10-22(11-4-1)26-16-9-17-27(20-26)30-32-29(24-13-5-2-6-14-24)33-31(34-30)28-19-18-23-12-7-8-15-25(23)21-28/h1-21H.
What are the key properties of 2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine?
2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine has a molecular weight of 435.53 g/mol, XLogP of 7.69, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine is sourced from PubChem (CID 163794965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).