bis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide)

C40H20F12N12Pt2 — CID 158735566

IUPACbis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide)
SMILESFC(F)(F)c1n[c-]c(-c2ccccn2)cn1.FC(F)(F)c1n[c-]c(-c2ccccn2)cn1.FC(F)(F)c1n[c-]c(-c2ccccn2)cn1.FC(F)(F)c1n[c-]c(-c2ccccn2)cn1.[Pt+2].[Pt+2]
InChIInChI=1S/4C10H5F3N3.2Pt/c4*11-10(12,13)9-15-5-7(6-16-9)8-3-1-2-4-14-8;;/h4*1-5H;;/q4*-1;2*+2
InChIKeyJKYUDIOKHAGPOA-UHFFFAOYSA-N
MW1286.82 g/mol
LogP9.43
Rot. Bonds4

About bis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide)

bis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide) (PubChem CID 158735566) has the molecular formula C40H20F12N12Pt2 and a molecular weight of 1286.82 g/mol. Its IUPAC name is bis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide).

Molecular Properties

Compound Namebis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide)
PubChem CID158735566
Molecular FormulaC40H20F12N12Pt2
Molecular Weight1286.82 g/mol
Exact Mass1286.10
IUPAC Namebis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide)
SMILESFC(F)(F)c1n[c-]c(-c2ccccn2)cn1.FC(F)(F)c1n[c-]c(-c2ccccn2)cn1.FC(F)(F)c1n[c-]c(-c2ccccn2)cn1.FC(F)(F)c1n[c-]c(-c2ccccn2)cn1.[Pt+2].[Pt+2]
InChIInChI=1S/4C10H5F3N3.2Pt/c4*11-10(12,13)9-15-5-7(6-16-9)8-3-1-2-4-14-8;;/h4*1-5H;;/q4*-1;2*+2
InChIKeyJKYUDIOKHAGPOA-UHFFFAOYSA-N
XLogP9.43
TPSA154.68 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds4
Heavy Atoms66
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001286.82
LogP ≤ 59.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

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Related Compounds

CID 154704206
CID 154704206
platinum;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;trifluoromethanesulfonic acid
CID 21024803
tris(2-pyridin-2-ylpyridine);ruthenium
CID 6100643
nickel;tris(2-pyridin-2-ylpyridine)
CID 76737267
bis(2-pyridin-2-ylpyridine);ruthenium
CID 87118114
2-pyridin-2-ylpyridine;ruthenium(2+)
CID 140596360
2-pyridin-2-ylpyridine;hydroiodide
CID 172833113
2-pyridin-2-ylpyridine;rhenium;tetrachloride
CID 52939847
2-pyridin-2-ylpyridine;dihydroiodide
CID 173445353
3-pyridin-2-yl-2-(trifluoromethyl)pyridine
CID 68525561
2-pyridin-2-yl-6-(trifluoromethyl)pyridine
CID 72771068
iridium;3-pyridin-2-yl-4H-pyridin-4-ide
CID 140686819

Frequently Asked Questions

What is the IUPAC name of bis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide)?
The IUPAC name of bis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide) (CID 158735566) is bis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide).
What is the SMILES notation for bis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide)?
The canonical SMILES for bis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide) is FC(F)(F)c1n[c-]c(-c2ccccn2)cn1.FC(F)(F)c1n[c-]c(-c2ccccn2)cn1.FC(F)(F)c1n[c-]c(-c2ccccn2)cn1.FC(F)(F)c1n[c-]c(-c2ccccn2)cn1.[Pt+2].[Pt+2].
What is the InChIKey of bis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide)?
The InChIKey is JKYUDIOKHAGPOA-UHFFFAOYSA-N. The full InChI is InChI=1S/4C10H5F3N3.2Pt/c4*11-10(12,13)9-15-5-7(6-16-9)8-3-1-2-4-14-8;;/h4*1-5H;;/q4*-1;2*+2.
What are the key properties of bis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide)?
bis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide) has a molecular weight of 1286.82 g/mol, XLogP of 9.43, 4 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for bis(platinum(2+));tetrakis(5-pyridin-2-yl-2-(trifluoromethyl)-4H-pyrimidin-4-ide) is sourced from PubChem (CID 158735566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).