2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine

C32H24N4 — CID 164758282

IUPAC2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine
SMILESc1ccc(C2=NC(c3cc(-c4ccccc4)cc(-c4ccncc4)c3)N=C(c3ccccc3)N2)cc1
InChIInChI=1S/C32H24N4/c1-4-10-23(11-5-1)27-20-28(24-16-18-33-19-17-24)22-29(21-27)32-35-30(25-12-6-2-7-13-25)34-31(36-32)26-14-8-3-9-15-26/h1-22,32H,(H,34,35,36)
InChIKeyNTHGFEWCWZHMTQ-UHFFFAOYSA-N
MW464.57 g/mol
LogP6.91
Rot. Bonds5

About 2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine

2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine (PubChem CID 164758282) has the molecular formula C32H24N4 and a molecular weight of 464.57 g/mol. Its IUPAC name is 2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine.

Molecular Properties

Compound Name2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine
PubChem CID164758282
Molecular FormulaC32H24N4
Molecular Weight464.57 g/mol
Exact Mass464.20
IUPAC Name2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine
SMILESc1ccc(C2=NC(c3cc(-c4ccccc4)cc(-c4ccncc4)c3)N=C(c3ccccc3)N2)cc1
InChIInChI=1S/C32H24N4/c1-4-10-23(11-5-1)27-20-28(24-16-18-33-19-17-24)22-29(21-27)32-35-30(25-12-6-2-7-13-25)34-31(36-32)26-14-8-3-9-15-26/h1-22,32H,(H,34,35,36)
InChIKeyNTHGFEWCWZHMTQ-UHFFFAOYSA-N
XLogP6.91
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.57
LogP ≤ 56.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3-methyl-5-phenylphenyl)-2,6-diphenyl-1,4-dihydro-1,3,5-triazine
CID 144615998
2-phenyl-4,6-bis[3-phenyl-5-(4-pyridin-2-ylphenyl)phenyl]-1,4-dihydro-1,3,5-triazine
CID 153197016
2,4,6-tris(3-phenylphenyl)-1,4-dihydro-1,3,5-triazine
CID 118543950
8-[3-[2-phenyl-6-(4-phenylphenyl)-1,4-dihydro-1,3,5-triazin-4-yl]-5-(4-pyridin-3-ylphenyl)phenyl]quinoline
CID 145384087
2-[4-(4-chlorophenyl)phenyl]-4,6-diphenyl-1,4-dihydro-1,3,5-triazine
CID 129197599
2-(4-bromophenyl)-4,6-diphenyl-1,4-dihydro-1,3,5-triazine
CID 122477886
2-[3-[4-(2,6-diphenyl-1,4-dihydro-1,3,5-triazin-4-yl)phenyl]phenyl]-1,3-benzoxazole
CID 174321370
4-[4-(3-phenylphenyl)phenyl]pyridine
CID 58943522
4-[3-[3-(3-naphtho[2,3-b][1]benzofuran-3-ylphenyl)phenyl]phenyl]-2,6-diphenyl-1,4-dihydro-1,3,5-triazine
CID 134299619
2-phenyl-4-(4-phenylphenyl)-6-[3-(4-phenylphenyl)dibenzofuran-1-yl]-1,4-dihydro-1,3,5-triazine
CID 170246810
azane;4-phenylpyridine
CID 175775455
2-phenyl-4-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,4-dihydro-1,3,5-triazine
CID 152940475

Frequently Asked Questions

What is the IUPAC name of 2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine?
The IUPAC name of 2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine (CID 164758282) is 2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine.
What is the SMILES notation for 2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine?
The canonical SMILES for 2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine is c1ccc(C2=NC(c3cc(-c4ccccc4)cc(-c4ccncc4)c3)N=C(c3ccccc3)N2)cc1.
What is the InChIKey of 2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine?
The InChIKey is NTHGFEWCWZHMTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H24N4/c1-4-10-23(11-5-1)27-20-28(24-16-18-33-19-17-24)22-29(21-27)32-35-30(25-12-6-2-7-13-25)34-31(36-32)26-14-8-3-9-15-26/h1-22,32H,(H,34,35,36).
What are the key properties of 2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine?
2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine has a molecular weight of 464.57 g/mol, XLogP of 6.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diphenyl-4-(3-phenyl-5-pyridin-4-ylphenyl)-1,4-dihydro-1,3,5-triazine is sourced from PubChem (CID 164758282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).