2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+))

C41H18F10N8Pt2 — CID 58756107

IUPAC2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+))
SMILESFc1c[c-]c(-c2cccc(C(c3cccc(-c4cc(C(F)(F)F)n[n-]4)n3)(c3cccc(-c4cc(C(F)(F)F)n[n-]4)n3)c3cccc(-c4[c-]cc(F)cc4F)n3)n2)c(F)c1.[Pt+2].[Pt+2]
InChIInChI=1S/C41H18F10N8.2Pt/c42-21-13-15-23(25(44)17-21)27-5-1-9-33(52-27)39(34-10-2-6-28(53-34)24-16-14-22(43)18-26(24)45,35-11-3-7-29(54-35)31-19-37(58-56-31)40(46,47)48)36-12-4-8-30(55-36)32-20-38(59-57-32)41(49,50)51;;/h1-14,17-20H;;/q-4;2*+2
InChIKeyCRDIWTFGMKTSBS-UHFFFAOYSA-N
MW1202.79 g/mol
LogP9.21
Rot. Bonds8

About 2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+))

2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+)) (PubChem CID 58756107) has the molecular formula C41H18F10N8Pt2 and a molecular weight of 1202.79 g/mol. Its IUPAC name is 2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+)).

Molecular Properties

Compound Name2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+))
PubChem CID58756107
Molecular FormulaC41H18F10N8Pt2
Molecular Weight1202.79 g/mol
Exact Mass1202.08
IUPAC Name2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+))
SMILESFc1c[c-]c(-c2cccc(C(c3cccc(-c4cc(C(F)(F)F)n[n-]4)n3)(c3cccc(-c4cc(C(F)(F)F)n[n-]4)n3)c3cccc(-c4[c-]cc(F)cc4F)n3)n2)c(F)c1.[Pt+2].[Pt+2]
InChIInChI=1S/C41H18F10N8.2Pt/c42-21-13-15-23(25(44)17-21)27-5-1-9-33(52-27)39(34-10-2-6-28(53-34)24-16-14-22(43)18-26(24)45,35-11-3-7-29(54-35)31-19-37(58-56-31)40(46,47)48)36-12-4-8-30(55-36)32-20-38(59-57-32)41(49,50)51;;/h1-14,17-20H;;/q-4;2*+2
InChIKeyCRDIWTFGMKTSBS-UHFFFAOYSA-N
XLogP9.21
TPSA105.54 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms61
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001202.79
LogP ≤ 59.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+)) with MolForge

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Related Compounds

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2,6-difluoro-3-[6-[2-[6-[4-fluoro-5-(trifluoromethyl)pyrazol-2-id-3-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;platinum(2+)
CID 57852067

Frequently Asked Questions

What is the IUPAC name of 2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+))?
The IUPAC name of 2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+)) (CID 58756107) is 2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+)).
What is the SMILES notation for 2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+))?
The canonical SMILES for 2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+)) is Fc1c[c-]c(-c2cccc(C(c3cccc(-c4cc(C(F)(F)F)n[n-]4)n3)(c3cccc(-c4cc(C(F)(F)F)n[n-]4)n3)c3cccc(-c4[c-]cc(F)cc4F)n3)n2)c(F)c1.[Pt+2].[Pt+2].
What is the InChIKey of 2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+))?
The InChIKey is CRDIWTFGMKTSBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H18F10N8.2Pt/c42-21-13-15-23(25(44)17-21)27-5-1-9-33(52-27)39(34-10-2-6-28(53-34)24-16-14-22(43)18-26(24)45,35-11-3-7-29(54-35)31-19-37(58-56-31)40(46,47)48)36-12-4-8-30(55-36)32-20-38(59-57-32)41(49,50)51;;/h1-14,17-20H;;/q-4;2*+2.
What are the key properties of 2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+))?
2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+)) has a molecular weight of 1202.79 g/mol, XLogP of 9.21, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]methyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(platinum(2+)) is sourced from PubChem (CID 58756107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).