4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum

C28H20N3Pt- — CID 58620904

IUPAC4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum
SMILES[Pt].[c-]1ccccc1Cc1cc(-c2ccccc2)cc(-c2cccc(-c3ccccn3)n2)n1
InChIInChI=1S/C28H20N3.Pt/c1-3-10-21(11-4-1)18-24-19-23(22-12-5-2-6-13-22)20-28(30-24)27-16-9-15-26(31-27)25-14-7-8-17-29-25;/h1-10,12-17,19-20H,18H2;/q-1;
InChIKeyRZNJEPCGDADSSM-UHFFFAOYSA-N
MW593.57 g/mol
LogP6.26
Rot. Bonds5

About 4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum

4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum (PubChem CID 58620904) has the molecular formula C28H20N3Pt- and a molecular weight of 593.57 g/mol. Its IUPAC name is 4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum.

Molecular Properties

Compound Name4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum
PubChem CID58620904
Molecular FormulaC28H20N3Pt-
Molecular Weight593.57 g/mol
Exact Mass593.13
IUPAC Name4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum
SMILES[Pt].[c-]1ccccc1Cc1cc(-c2ccccc2)cc(-c2cccc(-c3ccccn3)n2)n1
InChIInChI=1S/C28H20N3.Pt/c1-3-10-21(11-4-1)18-24-19-23(22-12-5-2-6-13-22)20-28(30-24)27-16-9-15-26(31-27)25-14-7-8-17-29-25;/h1-10,12-17,19-20H,18H2;/q-1;
InChIKeyRZNJEPCGDADSSM-UHFFFAOYSA-N
XLogP6.26
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500593.57
LogP ≤ 56.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-phenyl-2-[6-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]-6-pyridin-2-ylpyridine
CID 15788654
4-phenyl-2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-6-pyridin-2-ylpyridine;2-pyridin-2-yl-6-[4-(6-pyridin-2-yl-2-pyridinyl)phenyl]pyridine
CID 158535696
2-pyridin-2-yl-6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-4-[2-pyridin-2-yl-6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-4-pyridinyl]pyridine
CID 15448140
4-[3-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]-2,6-dipyridin-2-ylpyridine
CID 102048585
4-[6-[6-(2,6-dipyridin-2-yl-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]-2,6-dipyridin-2-ylpyridine
CID 171935887
iridium(3+);tris(2-(phenylmethyl)pyridine)
CID 58843926
4-[4-[2-[4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]-2,6-dipyridin-2-ylpyridine
CID 122364716
2-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)benzene-1,3-diol
CID 136711024
2,4-diphenyl-6-[3-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]phenyl]pyrimidine
CID 164817029
4-[2-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]-2,6-dipyridin-2-ylpyridine
CID 122364714
4-(4-chlorophenyl)-2,6-dipyridin-2-ylpyridine
CID 10871645
4-(3,5-dipyridin-2-ylphenyl)-2-phenyl-6-pyridin-2-ylpyridine
CID 23528039

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum?
The IUPAC name of 4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum (CID 58620904) is 4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum.
What is the SMILES notation for 4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum?
The canonical SMILES for 4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum is [Pt].[c-]1ccccc1Cc1cc(-c2ccccc2)cc(-c2cccc(-c3ccccn3)n2)n1.
What is the InChIKey of 4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum?
The InChIKey is RZNJEPCGDADSSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H20N3.Pt/c1-3-10-21(11-4-1)18-24-19-23(22-12-5-2-6-13-22)20-28(30-24)27-16-9-15-26(31-27)25-14-7-8-17-29-25;/h1-10,12-17,19-20H,18H2;/q-1;.
What are the key properties of 4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum?
4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum has a molecular weight of 593.57 g/mol, XLogP of 6.26, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-2-(phenylmethyl)-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;platinum is sourced from PubChem (CID 58620904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).