CID 150320751

H2N4O4S2 — CID 150320751

IUPAC—
SMILES[N-]=[N+]=NS(=O)(=O)S(N)(=O)=O
InChIInChI=1S/H2N4O4S2/c1-3-4-10(7,8)9(2,5)6/h(H2,2,5,6)
InChIKeyGNOSPCOOORAXQF-UHFFFAOYSA-N
MW186.17 g/mol
LogP-1.17
Rot. Bonds2

About CID 150320751

CID 150320751 (PubChem CID 150320751) has the molecular formula H2N4O4S2 and a molecular weight of 186.17 g/mol.

Molecular Properties

Compound NameCID 150320751
PubChem CID150320751
Molecular FormulaH2N4O4S2
Molecular Weight186.17 g/mol
Exact Mass185.95
IUPAC Name—
SMILES[N-]=[N+]=NS(=O)(=O)S(N)(=O)=O
InChIInChI=1S/H2N4O4S2/c1-3-4-10(7,8)9(2,5)6/h(H2,2,5,6)
InChIKeyGNOSPCOOORAXQF-UHFFFAOYSA-N
XLogP-1.17
TPSA143.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.17
LogP ≤ 5-1.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 150320751?
The IUPAC name of CID 150320751 (CID 150320751) is not available.
What is the SMILES notation for CID 150320751?
The canonical SMILES for CID 150320751 is [N-]=[N+]=NS(=O)(=O)S(N)(=O)=O.
What is the InChIKey of CID 150320751?
The InChIKey is GNOSPCOOORAXQF-UHFFFAOYSA-N. The full InChI is InChI=1S/H2N4O4S2/c1-3-4-10(7,8)9(2,5)6/h(H2,2,5,6).
What are the key properties of CID 150320751?
CID 150320751 has a molecular weight of 186.17 g/mol, XLogP of -1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 150320751 is sourced from PubChem (CID 150320751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).