2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine

C126H64F28N36Pt5 — CID 158064372

IUPAC2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine
SMILESCC(C)(c1cccc(-n2[c-]ccc2)n1)c1cccc(-n2[c-]ccc2)n1.FC(F)(F)c1c[c-]n(-c2cc(-c3ccccc3)cc(C(F)(F)c3cc(-c4ccccc4)cc(-n4[c-]cc(C(F)(F)F)n4)n3)n2)n1.FC(F)(F)c1c[c-]n(-c2cccc(C(c3cccc(-n4[c-]cc(C(F)(F)F)n4)n3)(C(F)(F)F)C(F)(F)F)n2)n1.[C-]#[N+]c1[c-]n(-c2cc(N(c3ccccc3)c3ccccc3)cc(C(F)(F)c3ccnc(-n4[c-]c(C#N)c(C(F)(F)F)n4)n3)n2)nc1C(F)(F)F.[C-]#[N+]c1c[c-]n(-c2cccc(C([N+]#[C-])([N+]#[C-])c3cccc(-n4[c-]cc(C#N)n4)n3)n2)n1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C32H14F8N10.C31H16F8N6.C21H8F12N6.C21H8N10.C21H18N4.5Pt/c1-42-23-18-48(47-28(23)32(38,39)40)26-15-22(50(20-8-4-2-5-9-20)21-10-6-3-7-11-21)14-25(44-26)30(33,34)24-12-13-43-29(45-24)49-17-19(16-41)27(46-49)31(35,36)37;32-29(33,25-15-21(19-7-3-1-4-8-19)17-27(40-25)44-13-11-23(42-44)30(34,35)36)26-16-22(20-9-5-2-6-10-20)18-28(41-26)45-14-12-24(43-45)31(37,38)39;22-18(23,24)13-7-9-38(36-13)15-5-1-3-11(34-15)17(20(28,29)30,21(31,32)33)12-4-2-6-16(35-12)39-10-8-14(37-39)19(25,26)27;1-23-18-11-13-31(29-18)20-9-5-7-17(27-20)21(24-2,25-3)16-6-4-8-19(26-16)30-12-10-15(14-22)28-30;1-21(2,17-9-7-11-19(22-17)24-13-3-4-14-24)18-10-8-12-20(23-18)25-15-5-6-16-25;;;;;/h2-15H;1-12,15-18H;1-8H;4-11H;3-13,15H,1-2H3;;;;;/q5*-2;5*+2
InChIKeySWPRHUUJFSBISJ-UHFFFAOYSA-N
MW3589.48 g/mol
LogP28.65
Rot. Bonds25

About 2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine

2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine (PubChem CID 158064372) has the molecular formula C126H64F28N36Pt5 and a molecular weight of 3589.48 g/mol. Its IUPAC name is 2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine.

Molecular Properties

Compound Name2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine
PubChem CID158064372
Molecular FormulaC126H64F28N36Pt5
Molecular Weight3589.48 g/mol
Exact Mass3587.39
IUPAC Name2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine
SMILESCC(C)(c1cccc(-n2[c-]ccc2)n1)c1cccc(-n2[c-]ccc2)n1.FC(F)(F)c1c[c-]n(-c2cc(-c3ccccc3)cc(C(F)(F)c3cc(-c4ccccc4)cc(-n4[c-]cc(C(F)(F)F)n4)n3)n2)n1.FC(F)(F)c1c[c-]n(-c2cccc(C(c3cccc(-n4[c-]cc(C(F)(F)F)n4)n3)(C(F)(F)F)C(F)(F)F)n2)n1.[C-]#[N+]c1[c-]n(-c2cc(N(c3ccccc3)c3ccccc3)cc(C(F)(F)c3ccnc(-n4[c-]c(C#N)c(C(F)(F)F)n4)n3)n2)nc1C(F)(F)F.[C-]#[N+]c1c[c-]n(-c2cccc(C([N+]#[C-])([N+]#[C-])c3cccc(-n4[c-]cc(C#N)n4)n3)n2)n1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C32H14F8N10.C31H16F8N6.C21H8F12N6.C21H8N10.C21H18N4.5Pt/c1-42-23-18-48(47-28(23)32(38,39)40)26-15-22(50(20-8-4-2-5-9-20)21-10-6-3-7-11-21)14-25(44-26)30(33,34)24-12-13-43-29(45-24)49-17-19(16-41)27(46-49)31(35,36)37;32-29(33,25-15-21(19-7-3-1-4-8-19)17-27(40-25)44-13-11-23(42-44)30(34,35)36)26-16-22(20-9-5-2-6-10-20)18-28(41-26)45-14-12-24(43-45)31(37,38)39;22-18(23,24)13-7-9-38(36-13)15-5-1-3-11(34-15)17(20(28,29)30,21(31,32)33)12-4-2-6-16(35-12)39-10-8-14(37-39)19(25,26)27;1-23-18-11-13-31(29-18)20-9-5-7-17(27-20)21(24-2,25-3)16-6-4-8-19(26-16)30-12-10-15(14-22)28-30;1-21(2,17-9-7-11-19(22-17)24-13-3-4-14-24)18-10-8-12-20(23-18)25-15-5-6-16-25;;;;;/h2-15H;1-12,15-18H;1-8H;4-11H;3-13,15H,1-2H3;;;;;/q5*-2;5*+2
InChIKeySWPRHUUJFSBISJ-UHFFFAOYSA-N
XLogP28.65
TPSA362.47 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds25
Heavy Atoms195
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003589.48
LogP ≤ 528.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

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

Analyze 2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine?
The IUPAC name of 2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine (CID 158064372) is 2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine.
What is the SMILES notation for 2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine?
The canonical SMILES for 2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine is CC(C)(c1cccc(-n2[c-]ccc2)n1)c1cccc(-n2[c-]ccc2)n1.FC(F)(F)c1c[c-]n(-c2cc(-c3ccccc3)cc(C(F)(F)c3cc(-c4ccccc4)cc(-n4[c-]cc(C(F)(F)F)n4)n3)n2)n1.FC(F)(F)c1c[c-]n(-c2cccc(C(c3cccc(-n4[c-]cc(C(F)(F)F)n4)n3)(C(F)(F)F)C(F)(F)F)n2)n1.[C-]#[N+]c1[c-]n(-c2cc(N(c3ccccc3)c3ccccc3)cc(C(F)(F)c3ccnc(-n4[c-]c(C#N)c(C(F)(F)F)n4)n3)n2)nc1C(F)(F)F.[C-]#[N+]c1c[c-]n(-c2cccc(C([N+]#[C-])([N+]#[C-])c3cccc(-n4[c-]cc(C#N)n4)n3)n2)n1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of 2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine?
The InChIKey is SWPRHUUJFSBISJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H14F8N10.C31H16F8N6.C21H8F12N6.C21H8N10.C21H18N4.5Pt/c1-42-23-18-48(47-28(23)32(38,39)40)26-15-22(50(20-8-4-2-5-9-20)21-10-6-3-7-11-21)14-25(44-26)30(33,34)24-12-13-43-29(45-24)49-17-19(16-41)27(46-49)31(35,36)37;32-29(33,25-15-21(19-7-3-1-4-8-19)17-27(40-25)44-13-11-23(42-44)30(34,35)36)26-16-22(20-9-5-2-6-10-20)18-28(41-26)45-14-12-24(43-45)31(37,38)39;22-18(23,24)13-7-9-38(36-13)15-5-1-3-11(34-15)17(20(28,29)30,21(31,32)33)12-4-2-6-16(35-12)39-10-8-14(37-39)19(25,26)27;1-23-18-11-13-31(29-18)20-9-5-7-17(27-20)21(24-2,25-3)16-6-4-8-19(26-16)30-12-10-15(14-22)28-30;1-21(2,17-9-7-11-19(22-17)24-13-3-4-14-24)18-10-8-12-20(23-18)25-15-5-6-16-25;;;;;/h2-15H;1-12,15-18H;1-8H;4-11H;3-13,15H,1-2H3;;;;;/q5*-2;5*+2.
What are the key properties of 2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine?
2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine has a molecular weight of 3589.48 g/mol, XLogP of 28.65, 25 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[difluoro-[6-[4-isocyano-5-(trifluoromethyl)-3H-pyrazol-3-id-2-yl]-4-(N-phenylanilino)-2-pyridinyl]methyl]pyrimidin-2-yl]-5-(trifluoromethyl)-3H-pyrazol-3-ide-4-carbonitrile;2-[difluoro-[4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]methyl]-4-phenyl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;1-[6-[diisocyano-[6-(3-isocyano-5H-pyrazol-5-id-1-yl)-2-pyridinyl]methyl]-2-pyridinyl]-5H-pyrazol-5-ide-3-carbonitrile;2-[1,1,1,3,3,3-hexafluoro-2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;pentakis(platinum(2+));2-(2H-pyrrol-2-id-1-yl)-6-[2-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine is sourced from PubChem (CID 158064372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).