bis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+)

C32H24F22N6O8PtS4 — CID 139109495

IUPACbis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+)
SMILESCC(C)(C)c1ccnc(-c2cc(C(C)(C)C)ccn2)c1.Fc1nc(F)c(F)c(F)c1F.Fc1nc(F)c(F)c(F)c1F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.[Pt+2]
InChIInChI=1S/C18H24N2.2C5F5N.2C2F6NO4S2.Pt/c1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6;2*6-1-2(7)4(9)11-5(10)3(1)8;2*3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;/h7-12H,1-6H3;;;;;/q;;;2*-1;+2
InChIKeyUZKXRSMWSZHXQV-UHFFFAOYSA-N
MW1361.88 g/mol
LogP10.41
Rot. Bonds5

About bis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+)

bis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+) (PubChem CID 139109495) has the molecular formula C32H24F22N6O8PtS4 and a molecular weight of 1361.88 g/mol. Its IUPAC name is bis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+).

Molecular Properties

Compound Namebis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+)
PubChem CID139109495
Molecular FormulaC32H24F22N6O8PtS4
Molecular Weight1361.88 g/mol
Exact Mass1360.98
IUPAC Namebis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+)
SMILESCC(C)(C)c1ccnc(-c2cc(C(C)(C)C)ccn2)c1.Fc1nc(F)c(F)c(F)c1F.Fc1nc(F)c(F)c(F)c1F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.[Pt+2]
InChIInChI=1S/C18H24N2.2C5F5N.2C2F6NO4S2.Pt/c1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6;2*6-1-2(7)4(9)11-5(10)3(1)8;2*3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;/h7-12H,1-6H3;;;;;/q;;;2*-1;+2
InChIKeyUZKXRSMWSZHXQV-UHFFFAOYSA-N
XLogP10.41
TPSA216.32 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds5
Heavy Atoms73
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001361.88
LogP ≤ 510.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of bis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+)?
The IUPAC name of bis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+) (CID 139109495) is bis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+).
What is the SMILES notation for bis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+)?
The canonical SMILES for bis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+) is CC(C)(C)c1ccnc(-c2cc(C(C)(C)C)ccn2)c1.Fc1nc(F)c(F)c(F)c1F.Fc1nc(F)c(F)c(F)c1F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.O=S(=O)([N-]S(=O)(=O)C(F)(F)F)C(F)(F)F.[Pt+2].
What is the InChIKey of bis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+)?
The InChIKey is UZKXRSMWSZHXQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2.2C5F5N.2C2F6NO4S2.Pt/c1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6;2*6-1-2(7)4(9)11-5(10)3(1)8;2*3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;/h7-12H,1-6H3;;;;;/q;;;2*-1;+2.
What are the key properties of bis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+)?
bis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+) has a molecular weight of 1361.88 g/mol, XLogP of 10.41, 5 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for bis(bis(trifluoromethylsulfonyl)azanide);4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2,3,4,5,6-pentafluoropyridine);platinum(2+) is sourced from PubChem (CID 139109495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).