CID 149433448

H3N3O4S2 — CID 149433448

IUPAC—
SMILESNS(=O)(=O)NN=S(=O)=O
InChIInChI=1S/H3N3O4S2/c1-9(6,7)3-2-8(4)5/h3H,(H2,1,6,7)
InChIKeyHEGGFRHWKDWLQG-UHFFFAOYSA-N
MW173.18 g/mol
LogP-2.24
Rot. Bonds2

About CID 149433448

CID 149433448 (PubChem CID 149433448) has the molecular formula H3N3O4S2 and a molecular weight of 173.18 g/mol.

Molecular Properties

Compound NameCID 149433448
PubChem CID149433448
Molecular FormulaH3N3O4S2
Molecular Weight173.18 g/mol
Exact Mass172.96
IUPAC Name—
SMILESNS(=O)(=O)NN=S(=O)=O
InChIInChI=1S/H3N3O4S2/c1-9(6,7)3-2-8(4)5/h3H,(H2,1,6,7)
InChIKeyHEGGFRHWKDWLQG-UHFFFAOYSA-N
XLogP-2.24
TPSA118.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.18
LogP ≤ 5-2.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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disodium;N-amino-N-sulfonatosulfamate
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Azanylidyneazanium disulfate
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N-amino-N-sulfonatosulfamate
CID 20132623

Frequently Asked Questions

What is the IUPAC name of CID 149433448?
The IUPAC name of CID 149433448 (CID 149433448) is not available.
What is the SMILES notation for CID 149433448?
The canonical SMILES for CID 149433448 is NS(=O)(=O)NN=S(=O)=O.
What is the InChIKey of CID 149433448?
The InChIKey is HEGGFRHWKDWLQG-UHFFFAOYSA-N. The full InChI is InChI=1S/H3N3O4S2/c1-9(6,7)3-2-8(4)5/h3H,(H2,1,6,7).
What are the key properties of CID 149433448?
CID 149433448 has a molecular weight of 173.18 g/mol, XLogP of -2.24, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 149433448 is sourced from PubChem (CID 149433448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).