2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol

C21H15N3O — CID 18552

IUPAC2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol
SMILESOc1ccccc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C21H15N3O/c25-18-14-8-7-13-17(18)21-23-19(15-9-3-1-4-10-15)22-20(24-21)16-11-5-2-6-12-16/h1-14,25H
InChIKeyFRSMLANYBOTORN-UHFFFAOYSA-N
MW325.37 g/mol
LogP4.58
Rot. Bonds3

About 2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol

2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol (PubChem CID 18552) has the molecular formula C21H15N3O and a molecular weight of 325.37 g/mol. Its IUPAC name is 2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol.

Molecular Properties

Compound Name2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol
PubChem CID18552
Molecular FormulaC21H15N3O
Molecular Weight325.37 g/mol
Exact Mass325.12
IUPAC Name2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol
SMILESOc1ccccc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C21H15N3O/c25-18-14-8-7-13-17(18)21-23-19(15-9-3-1-4-10-15)22-20(24-21)16-11-5-2-6-12-16/h1-14,25H
InChIKeyFRSMLANYBOTORN-UHFFFAOYSA-N
XLogP4.58
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol?
The IUPAC name of 2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol (CID 18552) is 2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol.
What is the SMILES notation for 2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol?
The canonical SMILES for 2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol is Oc1ccccc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.
What is the InChIKey of 2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol?
The InChIKey is FRSMLANYBOTORN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15N3O/c25-18-14-8-7-13-17(18)21-23-19(15-9-3-1-4-10-15)22-20(24-21)16-11-5-2-6-12-16/h1-14,25H.
What are the key properties of 2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol?
2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol has a molecular weight of 325.37 g/mol, XLogP of 4.58, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenol is sourced from PubChem (CID 18552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).