CID 20778728

H2S26 — CID 20778728

IUPAC—
SMILESSSSSSSSSSSSSSSSSSSSSSSSSSS
InChIInChI=1S/H2S26/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-24-22-20-18-16-14-12-10-8-6-4-2/h1-2H
InChIKeyYYBHZXZNXFXZOZ-UHFFFAOYSA-N
MW835.76 g/mol
LogP16.32
Rot. Bonds23

About CID 20778728

CID 20778728 (PubChem CID 20778728) has the molecular formula H2S26 and a molecular weight of 835.76 g/mol.

Molecular Properties

Compound NameCID 20778728
PubChem CID20778728
Molecular FormulaH2S26
Molecular Weight835.76 g/mol
Exact Mass833.29
IUPAC Name—
SMILESSSSSSSSSSSSSSSSSSSSSSSSSSS
InChIInChI=1S/H2S26/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-24-22-20-18-16-14-12-10-8-6-4-2/h1-2H
InChIKeyYYBHZXZNXFXZOZ-UHFFFAOYSA-N
XLogP16.32
TPSA0.00 Ų
H-Bond Donors2
H-Bond Acceptors26
Rotatable Bonds23
Heavy Atoms26
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500835.76
LogP ≤ 516.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

1,2,3,4,5,6,7,8,9,10,11,12-Dodecathiacyclododecane
CID 139047420
CID 15824437
CID 15824437
CID 17834069
CID 17834069
CID 17834072
CID 17834072
CID 17834076
CID 17834076
Bis[[(sulfanylidene-lambda4-sulfanylidene)-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfane
CID 18340587
Sulfanylidene-[[[[[[(sulfanylidene-lambda4-sulfanylidene)-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfane
CID 18340588
Bis[[[(sulfanylidene-lambda4-sulfanylidene)-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfane
CID 18340589
Sulfanylidene-[[[[[[[[(sulfanylidene-lambda4-sulfanylidene)-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfane
CID 18340590
Bis[[[[(sulfanylidene-lambda4-sulfanylidene)-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfane
CID 18340591
Sulfanylidene-[[[[(sulfanylidene-lambda4-sulfanylidene)-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfane
CID 18683329
Sulfanylidene-[[[[[[[[[[(sulfanylidene-lambda4-sulfanylidene)-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfanylidene]-lambda4-sulfane
CID 20645743

Frequently Asked Questions

What is the IUPAC name of CID 20778728?
The IUPAC name of CID 20778728 (CID 20778728) is not available.
What is the SMILES notation for CID 20778728?
The canonical SMILES for CID 20778728 is SSSSSSSSSSSSSSSSSSSSSSSSSS.
What is the InChIKey of CID 20778728?
The InChIKey is YYBHZXZNXFXZOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/H2S26/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-24-22-20-18-16-14-12-10-8-6-4-2/h1-2H.
What are the key properties of CID 20778728?
CID 20778728 has a molecular weight of 835.76 g/mol, XLogP of 16.32, 23 rotatable bonds, 2 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for CID 20778728 is sourced from PubChem (CID 20778728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).