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

C31H21N3 — CID 171592176

IUPAC2-naphthalen-1-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4cccc5ccccc45)n3)c2)cc1
InChIInChI=1S/C31H21N3/c1-3-11-22(12-4-1)25-17-9-18-26(21-25)30-32-29(24-14-5-2-6-15-24)33-31(34-30)28-20-10-16-23-13-7-8-19-27(23)28/h1-21H
InChIKeyVVRCONAUYOGOII-UHFFFAOYSA-N
MW435.53 g/mol
LogP7.69
Rot. Bonds4

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

2-naphthalen-1-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine (PubChem CID 171592176) has the molecular formula C31H21N3 and a molecular weight of 435.53 g/mol. Its IUPAC name is 2-naphthalen-1-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-naphthalen-1-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
PubChem CID171592176
Molecular FormulaC31H21N3
Molecular Weight435.53 g/mol
Exact Mass435.17
IUPAC Name2-naphthalen-1-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4cccc5ccccc45)n3)c2)cc1
InChIInChI=1S/C31H21N3/c1-3-11-22(12-4-1)25-17-9-18-26(21-25)30-32-29(24-14-5-2-6-15-24)33-31(34-30)28-20-10-16-23-13-7-8-19-27(23)28/h1-21H
InChIKeyVVRCONAUYOGOII-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-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-[3-(4-naphthalen-1-ylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 121311645
2,4,6-tris[3-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazine;2,4,6-tris[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazine
CID 158833777
2-[3-(3-bromophenyl)phenyl]-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine
CID 156561599
2-naphthalen-1-yl-4-(4-phenylphenyl)-6-(3-pyrimidin-2-ylphenyl)-1,3,5-triazine
CID 146586993
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-(5-naphthalen-1-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine
CID 168731887
2-[3-[3,5-bis(3-phenylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3,5-bis(4-phenylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[3-[3-(3-phenylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]-1,3,5-triazine;2-[3-[3-(3-naphthalen-1-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-(4-naphthalen-1-ylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-(4-naphthalen-1-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 161312431
2-[3-(2,4-diphenylphenyl)phenyl]-4-naphthalen-1-yl-6-(3-phenylphenyl)-1,3,5-triazine
CID 169297185
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
2,4-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

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine?
The IUPAC name of 2-naphthalen-1-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine (CID 171592176) is 2-naphthalen-1-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine.
What is the SMILES notation for 2-naphthalen-1-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine?
The canonical SMILES for 2-naphthalen-1-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine is c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4cccc5ccccc45)n3)c2)cc1.
What is the InChIKey of 2-naphthalen-1-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine?
The InChIKey is VVRCONAUYOGOII-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H21N3/c1-3-11-22(12-4-1)25-17-9-18-26(21-25)30-32-29(24-14-5-2-6-15-24)33-31(34-30)28-20-10-16-23-13-7-8-19-27(23)28/h1-21H.
What are the key properties of 2-naphthalen-1-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine?
2-naphthalen-1-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-1-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine is sourced from PubChem (CID 171592176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).