CID 175203237

C2H7O5S2Sb2-4 — CID 175203237

IUPAC
SMILESO=C([O-])CS.S=[Sb].[OH-].[OH-].[OH-].[SbH]
InChIInChI=1S/C2H4O2S.3H2O.S.2Sb.H/c3-2(4)1-5;;;;;;;/h5H,1H2,(H,3,4);3*1H2;;;;/p-4
InChIKeyAPJAXJYJBKHFKF-UHFFFAOYSA-J
MW418.73 g/mol
LogP-2.25
Rot. Bonds1

About CID 175203237

CID 175203237 (PubChem CID 175203237) has the molecular formula C2H7O5S2Sb2-4 and a molecular weight of 418.73 g/mol.

Molecular Properties

Compound NameCID 175203237
PubChem CID175203237
Molecular FormulaC2H7O5S2Sb2-4
Molecular Weight418.73 g/mol
Exact Mass416.78
IUPAC Name
SMILESO=C([O-])CS.S=[Sb].[OH-].[OH-].[OH-].[SbH]
InChIInChI=1S/C2H4O2S.3H2O.S.2Sb.H/c3-2(4)1-5;;;;;;;/h5H,1H2,(H,3,4);3*1H2;;;;/p-4
InChIKeyAPJAXJYJBKHFKF-UHFFFAOYSA-J
XLogP-2.25
TPSA130.13 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.73
LogP ≤ 5-2.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 175203237?
The IUPAC name of CID 175203237 (CID 175203237) is not available.
What is the SMILES notation for CID 175203237?
The canonical SMILES for CID 175203237 is O=C([O-])CS.S=[Sb].[OH-].[OH-].[OH-].[SbH].
What is the InChIKey of CID 175203237?
The InChIKey is APJAXJYJBKHFKF-UHFFFAOYSA-J. The full InChI is InChI=1S/C2H4O2S.3H2O.S.2Sb.H/c3-2(4)1-5;;;;;;;/h5H,1H2,(H,3,4);3*1H2;;;;/p-4.
What are the key properties of CID 175203237?
CID 175203237 has a molecular weight of 418.73 g/mol, XLogP of -2.25, 1 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175203237 is sourced from PubChem (CID 175203237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).