CID 19880505

C10H20N2PbS4-2 — CID 19880505

IUPAC—
SMILESCCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].[Pb]
InChIInChI=1S/2C5H11NS2.Pb/c2*1-3-6(4-2)5(7)8;/h2*3-4H2,1-2H3,(H,7,8);/p-2
InChIKeyUDRCIEGQSNCYGV-UHFFFAOYSA-L
MW503.75 g/mol
LogP1.94
Rot. Bonds4

About CID 19880505

CID 19880505 (PubChem CID 19880505) has the molecular formula C10H20N2PbS4-2 and a molecular weight of 503.75 g/mol.

Molecular Properties

Compound NameCID 19880505
PubChem CID19880505
Molecular FormulaC10H20N2PbS4-2
Molecular Weight503.75 g/mol
Exact Mass504.03
IUPAC Name—
SMILESCCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].[Pb]
InChIInChI=1S/2C5H11NS2.Pb/c2*1-3-6(4-2)5(7)8;/h2*3-4H2,1-2H3,(H,7,8);/p-2
InChIKeyUDRCIEGQSNCYGV-UHFFFAOYSA-L
XLogP1.94
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500503.75
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}, {'alert_name': 'thiol_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 19880505?
The IUPAC name of CID 19880505 (CID 19880505) is not available.
What is the SMILES notation for CID 19880505?
The canonical SMILES for CID 19880505 is CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].[Pb].
What is the InChIKey of CID 19880505?
The InChIKey is UDRCIEGQSNCYGV-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);/p-2.
What are the key properties of CID 19880505?
CID 19880505 has a molecular weight of 503.75 g/mol, XLogP of 1.94, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 19880505 is sourced from PubChem (CID 19880505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).