dimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum

C90H82OPt2S7+4 — CID 159125227

IUPACdimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum
SMILESC[S+](C)c1ccccc1.[CH2-][S+]([CH2-])c1ccccc1.[Pt].[Pt].c1ccc(Sc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1.c1ccc([S+](c2ccccc2)c2cccc3ccccc23)cc1.c1ccc([S+]2CCCC2)cc1.c1ccc([S+]2c3ccccc3Oc3ccccc32)cc1
InChIInChI=1S/C24H19S2.C22H17S.C18H13OS.C10H13S.C8H11S.C8H9S.2Pt/c1-4-10-20(11-5-1)25-21-16-18-24(19-17-21)26(22-12-6-2-7-13-22)23-14-8-3-9-15-23;1-3-12-19(13-4-1)23(20-14-5-2-6-15-20)22-17-9-11-18-10-7-8-16-21(18)22;1-2-8-14(9-3-1)20-17-12-6-4-10-15(17)19-16-11-5-7-13-18(16)20;1-2-6-10(7-3-1)11-8-4-5-9-11;2*1-9(2)8-6-4-3-5-7-8;;/h1-19H;1-17H;1-13H;1-3,6-7H,4-5,8-9H2;3-7H,1-2H3;3-7H,1-2H2;;/q5*+1;-1;;
InChIKeyLQNVYQLIEDFXMN-UHFFFAOYSA-N
MW1794.27 g/mol
LogP24.38
Rot. Bonds12

About dimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum

dimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum (PubChem CID 159125227) has the molecular formula C90H82OPt2S7+4 and a molecular weight of 1794.27 g/mol. Its IUPAC name is dimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum.

Molecular Properties

Compound Namedimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum
PubChem CID159125227
Molecular FormulaC90H82OPt2S7+4
Molecular Weight1794.27 g/mol
Exact Mass1792.37
IUPAC Namedimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum
SMILESC[S+](C)c1ccccc1.[CH2-][S+]([CH2-])c1ccccc1.[Pt].[Pt].c1ccc(Sc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1.c1ccc([S+](c2ccccc2)c2cccc3ccccc23)cc1.c1ccc([S+]2CCCC2)cc1.c1ccc([S+]2c3ccccc3Oc3ccccc32)cc1
InChIInChI=1S/C24H19S2.C22H17S.C18H13OS.C10H13S.C8H11S.C8H9S.2Pt/c1-4-10-20(11-5-1)25-21-16-18-24(19-17-21)26(22-12-6-2-7-13-22)23-14-8-3-9-15-23;1-3-12-19(13-4-1)23(20-14-5-2-6-15-20)22-17-9-11-18-10-7-8-16-21(18)22;1-2-8-14(9-3-1)20-17-12-6-4-10-15(17)19-16-11-5-7-13-18(16)20;1-2-6-10(7-3-1)11-8-4-5-9-11;2*1-9(2)8-6-4-3-5-7-8;;/h1-19H;1-17H;1-13H;1-3,6-7H,4-5,8-9H2;3-7H,1-2H3;3-7H,1-2H2;;/q5*+1;-1;;
InChIKeyLQNVYQLIEDFXMN-UHFFFAOYSA-N
XLogP24.38
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms100
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001794.27
LogP ≤ 524.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze dimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum with MolForge

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Related Compounds

bis(4-methylphenyl)-phenylsulfanium;dibutyl(naphthalen-1-yl)sulfanium;dimethyl(naphthalen-1-yl)sulfanium;(4-methylnaphthalen-1-yl)-diphenylsulfanium;1-naphthalen-1-ylthiolan-1-ium
CID 160886852
(4-hydroxyphenyl)-diphenylsulfanium;(4-methoxyphenyl)-diphenylsulfanium;10-phenylphenoxathiin-10-ium;tris(4-tert-butylphenyl)sulfanium
CID 158906179
phenyl-bis(4-phenylsulfanylphenyl)sulfanium
CID 21049843
bis[4-(4-diphenylsulfoniophenyl)sulfanylphenyl]-phenylsulfanium
CID 101131128
[4-(4-diphenylsulfoniophenyl)sulfanylphenyl]-diphenylsulfanium diiodide
CID 71358485
diphenyl-[4-(4-phenylsulfanylphenyl)phenyl]sulfanium
CID 140741745
carbanide;dimethyl(naphthalen-1-yl)sulfanium;ethane
CID 157387022
bis(4-diphenylsulfoniophenyl)-phenylsulfanium;diphenyl-[4-[phenyl-(4-phenylsulfanylphenyl)sulfonio]phenyl]sulfanium;(4-diphenylsulfoniophenyl)-diphenylsulfanium;[4-(4-diphenylsulfoniophenyl)phenyl]-diphenylsulfanium
CID 158008394
dimethyl(naphthalen-1-yl)sulfanium;ethane;propane
CID 169429862
diphenyl-[4-(4-phenylsulfanylphenyl)sulfanylphenyl]sulfanium;hexafluoroantimony(1-)
CID 71301088
[3-[(1Z)-buta-1,3-dienyl]phenyl]-naphthalen-1-yl-phenylsulfanium
CID 176725833
diphenyl-[4-(4-phenylsulfanylphenyl)sulfoniophenyl]sulfanium
CID 145340200

Frequently Asked Questions

What is the IUPAC name of dimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum?
The IUPAC name of dimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum (CID 159125227) is dimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum.
What is the SMILES notation for dimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum?
The canonical SMILES for dimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum is C[S+](C)c1ccccc1.[CH2-][S+]([CH2-])c1ccccc1.[Pt].[Pt].c1ccc(Sc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1.c1ccc([S+](c2ccccc2)c2cccc3ccccc23)cc1.c1ccc([S+]2CCCC2)cc1.c1ccc([S+]2c3ccccc3Oc3ccccc32)cc1.
What is the InChIKey of dimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum?
The InChIKey is LQNVYQLIEDFXMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19S2.C22H17S.C18H13OS.C10H13S.C8H11S.C8H9S.2Pt/c1-4-10-20(11-5-1)25-21-16-18-24(19-17-21)26(22-12-6-2-7-13-22)23-14-8-3-9-15-23;1-3-12-19(13-4-1)23(20-14-5-2-6-15-20)22-17-9-11-18-10-7-8-16-21(18)22;1-2-8-14(9-3-1)20-17-12-6-4-10-15(17)19-16-11-5-7-13-18(16)20;1-2-6-10(7-3-1)11-8-4-5-9-11;2*1-9(2)8-6-4-3-5-7-8;;/h1-19H;1-17H;1-13H;1-3,6-7H,4-5,8-9H2;3-7H,1-2H3;3-7H,1-2H2;;/q5*+1;-1;;.
What are the key properties of dimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum?
dimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum has a molecular weight of 1794.27 g/mol, XLogP of 24.38, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethanidyl(phenyl)sulfanium;dimethyl(phenyl)sulfanium;diphenyl-(4-phenylsulfanylphenyl)sulfanium;naphthalen-1-yl(diphenyl)sulfanium;10-phenylphenoxathiin-10-ium;1-phenylthiolan-1-ium;platinum is sourced from PubChem (CID 159125227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).