[2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+)

C25H8F10N2OPt — CID 59342235

IUPAC[2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+)
SMILESO=C(c1[c-]cc(F)c(C(F)(F)F)c1F)c1[c-]c(-c2cccc(-c3ccccn3)n2)c(F)c(C(F)(F)F)c1F.[Pt+2]
InChIInChI=1S/C25H8F10N2O.Pt/c26-14-8-7-11(20(27)18(14)24(30,31)32)23(38)13-10-12(21(28)19(22(13)29)25(33,34)35)15-5-3-6-17(37-15)16-4-1-2-9-36-16;/h1-6,8-9H;/q-2;+2
InChIKeyLARWKLDSNOKXMD-UHFFFAOYSA-N
MW737.41 g/mol
LogP7.23
Rot. Bonds4

About [2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+)

[2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+) (PubChem CID 59342235) has the molecular formula C25H8F10N2OPt and a molecular weight of 737.41 g/mol. Its IUPAC name is [2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+).

Molecular Properties

Compound Name[2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+)
PubChem CID59342235
Molecular FormulaC25H8F10N2OPt
Molecular Weight737.41 g/mol
Exact Mass737.01
IUPAC Name[2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+)
SMILESO=C(c1[c-]cc(F)c(C(F)(F)F)c1F)c1[c-]c(-c2cccc(-c3ccccn3)n2)c(F)c(C(F)(F)F)c1F.[Pt+2]
InChIInChI=1S/C25H8F10N2O.Pt/c26-14-8-7-11(20(27)18(14)24(30,31)32)23(38)13-10-12(21(28)19(22(13)29)25(33,34)35)15-5-3-6-17(37-15)16-4-1-2-9-36-16;/h1-6,8-9H;/q-2;+2
InChIKeyLARWKLDSNOKXMD-UHFFFAOYSA-N
XLogP7.23
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500737.41
LogP ≤ 57.23
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

Copper;2-pyridin-2-ylpyridine;bis(3-(trifluoromethyl)pyridin-1-id-2-one);hydrate
CID 139126663
neodymium(3+);2-pyridin-2-ylpyridine;tris((Z)-1,1,1-trifluoro-5,5-dimethyl-4-oxohex-2-en-2-olate)
CID 139172086
praseodymium(3+);2-pyridin-2-ylpyridine;tris((Z)-1,1,1-trifluoro-5,5-dimethyl-4-oxohex-2-en-2-olate)
CID 139172087
cerium(3+);2-pyridin-2-ylpyridine;tris((Z)-1,1,1-trifluoro-5,5-dimethyl-4-oxohex-2-en-2-olate)
CID 139172088
hexakis((Z)-1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-olate);bis(lanthanum(3+));bis(2-pyridin-2-ylpyridine)
CID 139173571
2-[3,5-bis(trifluoromethyl)pyrrol-1-id-2-yl]pyridine;(Z)-4-oxopent-2-en-2-olate;palladium(2+)
CID 139180940
2-(3,5-dimethylpyrrol-1-id-2-yl)pyridine;(Z)-1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-olate;palladium(2+)
CID 139180941
tris-(1,1,1,2,2,3,3-heptafluoro-7,7-dimethyl-4,6-octadionato-O,O')-(2,2'-bipyridine-N,N')-Dysprosium(III)
CID 139201595
tris(1,1,1-trifluoro-5,5-dimethyl-2,4-hexanedionate) mono(bipyridine)erbium(III)
CID 168354687
2-(2,4-Difluorobenzene-6-id-1-yl)pyridine;iridium;pyridin-2-ylmethyl-(2,2,2-trifluoroacetyl)azanide
CID 20807186
2-(2,4-Difluorobenzene-6-id-1-yl)pyridine;iridium;2-pyrazin-2-yl-6-(trifluoromethyl)pyridin-1-id-4-one
CID 20807268
2-[2,4-Bis(trifluoromethyl)benzene-6-id-1-yl]pyridine;iridium;1-pyridin-2-ylethyl-(2,2,2-trifluoroacetyl)azanide
CID 20807273

Frequently Asked Questions

What is the IUPAC name of [2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+)?
The IUPAC name of [2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+) (CID 59342235) is [2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+).
What is the SMILES notation for [2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+)?
The canonical SMILES for [2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+) is O=C(c1[c-]cc(F)c(C(F)(F)F)c1F)c1[c-]c(-c2cccc(-c3ccccn3)n2)c(F)c(C(F)(F)F)c1F.[Pt+2].
What is the InChIKey of [2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+)?
The InChIKey is LARWKLDSNOKXMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H8F10N2O.Pt/c26-14-8-7-11(20(27)18(14)24(30,31)32)23(38)13-10-12(21(28)19(22(13)29)25(33,34)35)15-5-3-6-17(37-15)16-4-1-2-9-36-16;/h1-6,8-9H;/q-2;+2.
What are the key properties of [2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+)?
[2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+) has a molecular weight of 737.41 g/mol, XLogP of 7.23, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2,4-difluoro-5-(6-pyridin-2-yl-2-pyridinyl)-3-(trifluoromethyl)benzene-6-id-1-yl]-[2,4-difluoro-3-(trifluoromethyl)benzene-6-id-1-yl]methanone;platinum(2+) is sourced from PubChem (CID 59342235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).