bis(diethylcarbamothioylsulfanyl)lead

C10H20N2PbS4 — CID 16685131

IUPACbis(diethylcarbamothioylsulfanyl)lead
SMILESCCN(CC)C(=S)S[Pb]SC(=S)N(CC)CC
InChIInChI=1S/2C5H11NS2.Pb/c2*1-3-6(4-2)5(7)8;/h2*3-4H2,1-2H3,(H,7,8);/q;;+2/p-2
InChIKeyXTFSWQKNABTKAT-UHFFFAOYSA-L
MW503.75 g/mol
LogP3.24
Rot. Bonds6

About bis(diethylcarbamothioylsulfanyl)lead

bis(diethylcarbamothioylsulfanyl)lead (PubChem CID 16685131) has the molecular formula C10H20N2PbS4 and a molecular weight of 503.75 g/mol. Its IUPAC name is bis(diethylcarbamothioylsulfanyl)lead.

Molecular Properties

Compound Namebis(diethylcarbamothioylsulfanyl)lead
PubChem CID16685131
Molecular FormulaC10H20N2PbS4
Molecular Weight503.75 g/mol
Exact Mass504.03
IUPAC Namebis(diethylcarbamothioylsulfanyl)lead
SMILESCCN(CC)C(=S)S[Pb]SC(=S)N(CC)CC
InChIInChI=1S/2C5H11NS2.Pb/c2*1-3-6(4-2)5(7)8;/h2*3-4H2,1-2H3,(H,7,8);/q;;+2/p-2
InChIKeyXTFSWQKNABTKAT-UHFFFAOYSA-L
XLogP3.24
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500503.75
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

diethylcarbamothioylsulfanyl N,N-diethylcarbamodithioate;gold
CID 87918592
(diethylcarbamothioyltrisulfanyl) N,N-diethylcarbamodithioate
CID 54321887
zinc;bis(dibutylcarbamothioylsulfanyl)lead;bis(N,N-dibutylcarbamodithioate)
CID 162392913
diethylcarbamothioylsulfanyl N,N-diethylcarbamodithioate;bis(dimethylcarbamothioylsulfanyl N,N-dimethylcarbamodithioate)
CID 174871842
S-(diethylcarbamothioylsulfanyl) N,N-diethylcarbamothioate
CID 122489157
[diethylcarbamothioylsulfanyl(iodo)bismuthanyl] N,N-diethylcarbamodithioate
CID 6329123
dibutylcarbamothioylsulfanyl N,N-dibutylcarbamodithioate;diethylcarbamothioylsulfanyl N,N-diethylcarbamodithioate
CID 90091780
3-hydroxypropyl N,N-diethylcarbamodithioate
CID 16726125
[tert-butyl(dimethyl)silyl] N,N-diethylcarbamodithioate
CID 91733838
(3-hydroxy-3-methylbutyl) N,N-diethylcarbamodithioate
CID 111753425
8-hydroxyoctyl N,N-diethylcarbamodithioate
CID 15486285
N,N-diethylcarbamodithioate
CID 28343

Frequently Asked Questions

What is the IUPAC name of bis(diethylcarbamothioylsulfanyl)lead?
The IUPAC name of bis(diethylcarbamothioylsulfanyl)lead (CID 16685131) is bis(diethylcarbamothioylsulfanyl)lead.
What is the SMILES notation for bis(diethylcarbamothioylsulfanyl)lead?
The canonical SMILES for bis(diethylcarbamothioylsulfanyl)lead is CCN(CC)C(=S)S[Pb]SC(=S)N(CC)CC.
What is the InChIKey of bis(diethylcarbamothioylsulfanyl)lead?
The InChIKey is XTFSWQKNABTKAT-UHFFFAOYSA-L. The full InChI is InChI=1S/2C5H11NS2.Pb/c2*1-3-6(4-2)5(7)8;/h2*3-4H2,1-2H3,(H,7,8);/q;;+2/p-2.
What are the key properties of bis(diethylcarbamothioylsulfanyl)lead?
bis(diethylcarbamothioylsulfanyl)lead has a molecular weight of 503.75 g/mol, XLogP of 3.24, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(diethylcarbamothioylsulfanyl)lead is sourced from PubChem (CID 16685131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).