2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine

C35H23N3 — CID 156903781

IUPAC2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine
SMILESc1ccc(-c2ncnc(-c3cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c3)n2)cc1
InChIInChI=1S/C35H23N3/c1-3-12-24(13-4-1)32-28-18-7-9-20-30(28)33(31-21-10-8-19-29(31)32)26-16-11-17-27(22-26)35-37-23-36-34(38-35)25-14-5-2-6-15-25/h1-23H
InChIKeyZPXGGNHFFYDWRY-UHFFFAOYSA-N
MW485.59 g/mol
LogP8.85
Rot. Bonds4

About 2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine

2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine (PubChem CID 156903781) has the molecular formula C35H23N3 and a molecular weight of 485.59 g/mol. Its IUPAC name is 2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine.

Molecular Properties

Compound Name2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine
PubChem CID156903781
Molecular FormulaC35H23N3
Molecular Weight485.59 g/mol
Exact Mass485.19
IUPAC Name2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine
SMILESc1ccc(-c2ncnc(-c3cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c3)n2)cc1
InChIInChI=1S/C35H23N3/c1-3-12-24(13-4-1)32-28-18-7-9-20-30(28)33(31-21-10-8-19-29(31)32)26-16-11-17-27(22-26)35-37-23-36-34(38-35)25-14-5-2-6-15-25/h1-23H
InChIKeyZPXGGNHFFYDWRY-UHFFFAOYSA-N
XLogP8.85
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500485.59
LogP ≤ 58.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

2-phenyl-4-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine
CID 134581962
2-[3-(9,10-diphenylanthracen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 90361453
2-naphthalen-2-yl-4-[3-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-6-phenyl-1,3,5-triazine
CID 153301943
2,4-diphenyl-6-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]-1,3,5-triazine
CID 138553182
2,4-diphenyl-6-(10-phenylanthracen-9-yl)-1,3,5-triazine
CID 58454367
2-(3-methylphenyl)-4-phenyl-1,3,5-triazine
CID 134408534
2-phenyl-4-(3-phenylphenyl)-6-[3-[10-[2-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]-1,3,5-triazine
CID 147995292
2-phenyl-4-[4-(4-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine
CID 118583036
9-(3-anthracen-9-ylphenyl)-10-phenylanthracene
CID 58321138
2-(2,6-dimethyl-3-pyridinyl)-4-phenyl-6-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine
CID 155773765
9-(3-phenylphenyl)-10-[4-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]anthracene
CID 59557543
2-[3-(1,4-diphenylnaphthalen-2-yl)phenyl]-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
CID 171730885

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine?
The IUPAC name of 2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine (CID 156903781) is 2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine.
What is the SMILES notation for 2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine?
The canonical SMILES for 2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine is c1ccc(-c2ncnc(-c3cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c3)n2)cc1.
What is the InChIKey of 2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine?
The InChIKey is ZPXGGNHFFYDWRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H23N3/c1-3-12-24(13-4-1)32-28-18-7-9-20-30(28)33(31-21-10-8-19-29(31)32)26-16-11-17-27(22-26)35-37-23-36-34(38-35)25-14-5-2-6-15-25/h1-23H.
What are the key properties of 2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine?
2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine has a molecular weight of 485.59 g/mol, XLogP of 8.85, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-[3-(10-phenylanthracen-9-yl)phenyl]-1,3,5-triazine is sourced from PubChem (CID 156903781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).