platinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol)

C38H28N4O2Pt2-2 — CID 177296373

IUPACplatinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol)
SMILESOc1ccccc1-c1ccccn1.Oc1ccccc1-c1ccccn1.[Pt].[Pt].[c-]1cc(-c2ccccn2)[c-]cc1-c1ccccn1
InChIInChI=1S/C16H10N2.2C11H9NO.2Pt/c1-3-11-17-15(5-1)13-7-9-14(10-8-13)16-6-2-4-12-18-16;2*13-11-7-2-1-5-9(11)10-6-3-4-8-12-10;;/h1-7,10-12H;2*1-8,13H;;/q-2;;;;
InChIKeyRSLJZFNJAHCNJU-UHFFFAOYSA-N
MW962.82 g/mol
LogP8.31
Rot. Bonds4

About platinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol)

platinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol) (PubChem CID 177296373) has the molecular formula C38H28N4O2Pt2-2 and a molecular weight of 962.82 g/mol. Its IUPAC name is platinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol).

Molecular Properties

Compound Nameplatinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol)
PubChem CID177296373
Molecular FormulaC38H28N4O2Pt2-2
Molecular Weight962.82 g/mol
Exact Mass962.15
IUPAC Nameplatinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol)
SMILESOc1ccccc1-c1ccccn1.Oc1ccccc1-c1ccccn1.[Pt].[Pt].[c-]1cc(-c2ccccn2)[c-]cc1-c1ccccn1
InChIInChI=1S/C16H10N2.2C11H9NO.2Pt/c1-3-11-17-15(5-1)13-7-9-14(10-8-13)16-6-2-4-12-18-16;2*13-11-7-2-1-5-9(11)10-6-3-4-8-12-10;;/h1-7,10-12H;2*1-8,13H;;/q-2;;;;
InChIKeyRSLJZFNJAHCNJU-UHFFFAOYSA-N
XLogP8.31
TPSA92.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500962.82
LogP ≤ 58.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze platinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol) with MolForge

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Related Compounds

2-[6-(3-Hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol
CID 137091036
2-[6-(3-Hydroxyphenyl)-4-pyridin-3-yl-2-pyridinyl]phenol
CID 137091041
2-[6-(2-Hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol
CID 137091035
2-[6-(2-Hydroxyphenyl)-4-pyridin-3-yl-2-pyridinyl]phenol
CID 137091040
2,6-Bis(bis(2-pyridylmethyl)aminomethyl)-4-methylphenol
CID 11756790
Dicopper;bis(2-[[[2-hydroxy-3-(trifluoromethyl)phenyl]methyl-(pyridin-2-ylmethyl)amino]methyl]-6-(trifluoromethyl)phenolate);diacetate
CID 139170910
2-[[2-[(2-Hydroxyphenyl)methyl-(pyridin-2-ylmethyl)amino]ethyl-(pyridin-2-ylmethyl)amino]methyl]phenol
CID 15493502
2-[[6-[2,4-Difluoro-5-pyridin-2-yl-3-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]methyl]phenol;platinum
CID 58004397
2-(2,4-Difluorobenzene-6-id-1-yl)-6-[4-(phenoxy)-1-pyridin-2-yl-1-[6-(trifluoromethyl)-2-pyridinyl]butyl]pyridine;iridium;phenol
CID 58621418
Bis(4-hydroxypent-3-en-2-one);hexakis(iridium);2-(3-methylbenzene-6-id-1-yl)pyridine;2-(4-methylbenzene-6-id-1-yl)pyridine;2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylphenol;tris(2-phenylpyridine);platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;2-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine
CID 159017779
2-((Bis(pyridin-2-ylmethyl)amino)methyl)-6-(((2-hydroxybenzyl)(pyridin-2-ylmethyl)amino)methyl)-4-methylphenol
CID 11445866
2-[[[(1R,2R)-2-[(2-hydroxyphenyl)methyl-(pyridin-2-ylmethyl)amino]-1,2-diphenylethyl]-(pyridin-2-ylmethyl)amino]methyl]phenol
CID 11520037

Frequently Asked Questions

What is the IUPAC name of platinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol)?
The IUPAC name of platinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol) (CID 177296373) is platinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol).
What is the SMILES notation for platinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol)?
The canonical SMILES for platinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol) is Oc1ccccc1-c1ccccn1.Oc1ccccc1-c1ccccn1.[Pt].[Pt].[c-]1cc(-c2ccccn2)[c-]cc1-c1ccccn1.
What is the InChIKey of platinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol)?
The InChIKey is RSLJZFNJAHCNJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N2.2C11H9NO.2Pt/c1-3-11-17-15(5-1)13-7-9-14(10-8-13)16-6-2-4-12-18-16;2*13-11-7-2-1-5-9(11)10-6-3-4-8-12-10;;/h1-7,10-12H;2*1-8,13H;;/q-2;;;;.
What are the key properties of platinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol)?
platinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol) has a molecular weight of 962.82 g/mol, XLogP of 8.31, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for platinum;2-(4-pyridin-2-ylbenzene-3,6-diid-1-yl)pyridine;bis(2-pyridin-2-ylphenol) is sourced from PubChem (CID 177296373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).