CID 152570710

H3NO5S3 — CID 152570710

IUPAC—
SMILESO=S(O)SNS(=O)(=O)O
InChIInChI=1S/H3NO5S3/c2-8(3)7-1-9(4,5)6/h1H,(H,2,3)(H,4,5,6)
InChIKeyGKHNLGWDOHKKSJ-UHFFFAOYSA-N
MW193.23 g/mol
LogP-0.84
Rot. Bonds3

About CID 152570710

CID 152570710 (PubChem CID 152570710) has the molecular formula H3NO5S3 and a molecular weight of 193.23 g/mol.

Molecular Properties

Compound NameCID 152570710
PubChem CID152570710
Molecular FormulaH3NO5S3
Molecular Weight193.23 g/mol
Exact Mass192.92
IUPAC Name—
SMILESO=S(O)SNS(=O)(=O)O
InChIInChI=1S/H3NO5S3/c2-8(3)7-1-9(4,5)6/h1H,(H,2,3)(H,4,5,6)
InChIKeyGKHNLGWDOHKKSJ-UHFFFAOYSA-N
XLogP-0.84
TPSA103.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.23
LogP ≤ 5-0.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'sulfinic_acid', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'sulphur_nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 152570710?
The IUPAC name of CID 152570710 (CID 152570710) is not available.
What is the SMILES notation for CID 152570710?
The canonical SMILES for CID 152570710 is O=S(O)SNS(=O)(=O)O.
What is the InChIKey of CID 152570710?
The InChIKey is GKHNLGWDOHKKSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/H3NO5S3/c2-8(3)7-1-9(4,5)6/h1H,(H,2,3)(H,4,5,6).
What are the key properties of CID 152570710?
CID 152570710 has a molecular weight of 193.23 g/mol, XLogP of -0.84, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 152570710 is sourced from PubChem (CID 152570710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).