2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine

C24H16N6 — CID 144765788

IUPAC2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccc(-c4ccncc4)cc3)nc(-c3ccccn3)n2)nc1
InChIInChI=1S/C24H16N6/c1-3-13-26-20(5-1)23-28-22(29-24(30-23)21-6-2-4-14-27-21)19-9-7-17(8-10-19)18-11-15-25-16-12-18/h1-16H
InChIKeyOSPAVSQLEVCDCX-UHFFFAOYSA-N
MW388.43 g/mol
LogP4.72
Rot. Bonds4

About 2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine

2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine (PubChem CID 144765788) has the molecular formula C24H16N6 and a molecular weight of 388.43 g/mol. Its IUPAC name is 2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine
PubChem CID144765788
Molecular FormulaC24H16N6
Molecular Weight388.43 g/mol
Exact Mass388.14
IUPAC Name2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccc(-c4ccncc4)cc3)nc(-c3ccccn3)n2)nc1
InChIInChI=1S/C24H16N6/c1-3-13-26-20(5-1)23-28-22(29-24(30-23)21-6-2-4-14-27-21)19-9-7-17(8-10-19)18-11-15-25-16-12-18/h1-16H
InChIKeyOSPAVSQLEVCDCX-UHFFFAOYSA-N
XLogP4.72
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.43
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine?
The IUPAC name of 2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine (CID 144765788) is 2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine.
What is the SMILES notation for 2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine?
The canonical SMILES for 2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine is c1ccc(-c2nc(-c3ccc(-c4ccncc4)cc3)nc(-c3ccccn3)n2)nc1.
What is the InChIKey of 2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine?
The InChIKey is OSPAVSQLEVCDCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N6/c1-3-13-26-20(5-1)23-28-22(29-24(30-23)21-6-2-4-14-27-21)19-9-7-17(8-10-19)18-11-15-25-16-12-18/h1-16H.
What are the key properties of 2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine?
2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine has a molecular weight of 388.43 g/mol, XLogP of 4.72, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine is sourced from PubChem (CID 144765788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).