platinum(2+);bis(1-propylsulfinylpropane);dichloride

C12H28Cl2O2PtS2 — CID 3082519

IUPACplatinum(2+);bis(1-propylsulfinylpropane);dichloride
SMILESCCCS(=O)CCC.CCCS(=O)CCC.[Cl-].[Cl-].[Pt+2]
InChIInChI=1S/2C6H14OS.2ClH.Pt/c2*1-3-5-8(7)6-4-2;;;/h2*3-6H2,1-2H3;2*1H;/q;;;;+2/p-2
InChIKeyCIFHTLPMYBXVEY-UHFFFAOYSA-L
MW534.47 g/mol
LogP-2.88
Rot. Bonds8

About platinum(2+);bis(1-propylsulfinylpropane);dichloride

platinum(2+);bis(1-propylsulfinylpropane);dichloride (PubChem CID 3082519) has the molecular formula C12H28Cl2O2PtS2 and a molecular weight of 534.47 g/mol. Its IUPAC name is platinum(2+);bis(1-propylsulfinylpropane);dichloride.

Molecular Properties

Compound Nameplatinum(2+);bis(1-propylsulfinylpropane);dichloride
PubChem CID3082519
Molecular FormulaC12H28Cl2O2PtS2
Molecular Weight534.47 g/mol
Exact Mass533.06
IUPAC Nameplatinum(2+);bis(1-propylsulfinylpropane);dichloride
SMILESCCCS(=O)CCC.CCCS(=O)CCC.[Cl-].[Cl-].[Pt+2]
InChIInChI=1S/2C6H14OS.2ClH.Pt/c2*1-3-5-8(7)6-4-2;;;/h2*3-6H2,1-2H3;2*1H;/q;;;;+2/p-2
InChIKeyCIFHTLPMYBXVEY-UHFFFAOYSA-L
XLogP-2.88
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500534.47
LogP ≤ 5-2.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-propylsulfinylbutane
CID 564183
3-[(R)-propylsulfinyl]propan-1-amine
CID 88509307
3-propylsulfinylpropan-1-amine
CID 58684721
1-azido-3-propylsulfinylpropane
CID 61396915
3-propylsulfinylpropanethioic S-acid
CID 20544814
6-propylsulfinylhexan-2-one
CID 64640281
1-heptadecylsulfinylheptadecane
CID 54059826
azanylidyne-oxo-propyl-λ6-sulfane
CID 90138662
1-(2,2-dimethoxyethylsulfinyl)propane
CID 66222196
1-[2-(2-propylsulfanylethylsulfinyl)ethylsulfanyl]propane
CID 12636145
N-propyl-1-propylsulfinylpentan-2-amine
CID 64650923
N-ethyl-6-propylsulfinylhexan-3-amine
CID 106807953

Frequently Asked Questions

What is the IUPAC name of platinum(2+);bis(1-propylsulfinylpropane);dichloride?
The IUPAC name of platinum(2+);bis(1-propylsulfinylpropane);dichloride (CID 3082519) is platinum(2+);bis(1-propylsulfinylpropane);dichloride.
What is the SMILES notation for platinum(2+);bis(1-propylsulfinylpropane);dichloride?
The canonical SMILES for platinum(2+);bis(1-propylsulfinylpropane);dichloride is CCCS(=O)CCC.CCCS(=O)CCC.[Cl-].[Cl-].[Pt+2].
What is the InChIKey of platinum(2+);bis(1-propylsulfinylpropane);dichloride?
The InChIKey is CIFHTLPMYBXVEY-UHFFFAOYSA-L. The full InChI is InChI=1S/2C6H14OS.2ClH.Pt/c2*1-3-5-8(7)6-4-2;;;/h2*3-6H2,1-2H3;2*1H;/q;;;;+2/p-2.
What are the key properties of platinum(2+);bis(1-propylsulfinylpropane);dichloride?
platinum(2+);bis(1-propylsulfinylpropane);dichloride has a molecular weight of 534.47 g/mol, XLogP of -2.88, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for platinum(2+);bis(1-propylsulfinylpropane);dichloride is sourced from PubChem (CID 3082519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).