2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine

C35H21F2N3 — CID 164970095

IUPAC2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine
SMILESFc1cc(F)cc(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc4c(-c5ccccc5)cccc4c3)n2)c1
InChIInChI=1S/C35H21F2N3/c36-29-19-28(20-30(37)21-29)35-39-33(26-14-13-22-7-4-5-10-24(22)17-26)38-34(40-35)27-15-16-32-25(18-27)11-6-12-31(32)23-8-2-1-3-9-23/h1-21H
InChIKeyFMCRFXFADQLUCM-UHFFFAOYSA-N
MW521.57 g/mol
LogP9.12
Rot. Bonds4

About 2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine

2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine (PubChem CID 164970095) has the molecular formula C35H21F2N3 and a molecular weight of 521.57 g/mol. Its IUPAC name is 2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine
PubChem CID164970095
Molecular FormulaC35H21F2N3
Molecular Weight521.57 g/mol
Exact Mass521.17
IUPAC Name2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine
SMILESFc1cc(F)cc(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc4c(-c5ccccc5)cccc4c3)n2)c1
InChIInChI=1S/C35H21F2N3/c36-29-19-28(20-30(37)21-29)35-39-33(26-14-13-22-7-4-5-10-24(22)17-26)38-34(40-35)27-15-16-32-25(18-27)11-6-12-31(32)23-8-2-1-3-9-23/h1-21H
InChIKeyFMCRFXFADQLUCM-UHFFFAOYSA-N
XLogP9.12
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500521.57
LogP ≤ 59.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-naphthalen-1-ylphenyl)-4-(5-phenylnaphthalen-2-yl)-6-[3-(6-phenylnaphthalen-2-yl)phenyl]-1,3,5-triazine
CID 166022163
2-(6-naphthalen-2-ylnaphthalen-2-yl)-4-(3-naphthalen-2-ylphenyl)-6-(6-phenylnaphthalen-1-yl)-1,3,5-triazine
CID 177076693
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-naphthalen-2-ylnaphthalen-2-yl)-4-(4-naphthalen-1-ylphenyl)-6-(6-phenylnaphthalen-1-yl)-1,3,5-triazine
CID 177076754
2-naphthalen-2-yl-4-[3-(4-phenylnaphthalen-1-yl)phenyl]-6-[4-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine
CID 177278748
2-naphthalen-2-yl-4-phenanthren-2-yl-6-[3-(4-phenylnaphthalen-1-yl)phenyl]-1,3,5-triazine
CID 174232916
2,4-dinaphthalen-2-yl-6-[3-naphthalen-1-yl-5-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 122416036
2-naphthalen-1-yl-4-(6-naphthalen-1-ylnaphthalen-2-yl)-6-(5-phenylnaphthalen-1-yl)-1,3,5-triazine
CID 177076826
2,4-dinaphthalen-2-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-[4-(4-naphthalen-1-ylphenyl)phenyl]-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 165085308
2,4-dinaphthalen-2-yl-6-(6-naphthalen-1-ylnaphthalen-2-yl)-1,3,5-triazine
CID 164745897
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-(4-naphthalen-1-ylphenyl)phenyl]-4-(6-phenylnaphthalen-2-yl)-6-(3-phenylphenyl)-1,3,5-triazine
CID 169302485

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine?
The IUPAC name of 2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine (CID 164970095) is 2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine.
What is the SMILES notation for 2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine?
The canonical SMILES for 2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine is Fc1cc(F)cc(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc4c(-c5ccccc5)cccc4c3)n2)c1.
What is the InChIKey of 2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine?
The InChIKey is FMCRFXFADQLUCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H21F2N3/c36-29-19-28(20-30(37)21-29)35-39-33(26-14-13-22-7-4-5-10-24(22)17-26)38-34(40-35)27-15-16-32-25(18-27)11-6-12-31(32)23-8-2-1-3-9-23/h1-21H.
What are the key properties of 2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine?
2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine has a molecular weight of 521.57 g/mol, XLogP of 9.12, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-difluorophenyl)-4-naphthalen-2-yl-6-(5-phenylnaphthalen-2-yl)-1,3,5-triazine is sourced from PubChem (CID 164970095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).