CID 170843432

H2Cs2O4Se — CID 170843432

IUPAC
SMILESO=[Se](=O)(O)O.[Cs].[Cs]
InChIInChI=1S/2Cs.H2O4Se/c;;1-5(2,3)4/h;;(H2,1,2,3,4)
InChIKeyMHWGIAQEEAXCMN-UHFFFAOYSA-N
MW410.78 g/mol
LogP-2.49
Rot. Bonds

About CID 170843432

CID 170843432 (PubChem CID 170843432) has the molecular formula H2Cs2O4Se and a molecular weight of 410.78 g/mol.

Molecular Properties

Compound NameCID 170843432
PubChem CID170843432
Molecular FormulaH2Cs2O4Se
Molecular Weight410.78 g/mol
Exact Mass411.72
IUPAC Name
SMILESO=[Se](=O)(O)O.[Cs].[Cs]
InChIInChI=1S/2Cs.H2O4Se/c;;1-5(2,3)4/h;;(H2,1,2,3,4)
InChIKeyMHWGIAQEEAXCMN-UHFFFAOYSA-N
XLogP-2.49
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.78
LogP ≤ 5-2.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 170843432?
The IUPAC name of CID 170843432 (CID 170843432) is not available.
What is the SMILES notation for CID 170843432?
The canonical SMILES for CID 170843432 is O=[Se](=O)(O)O.[Cs].[Cs].
What is the InChIKey of CID 170843432?
The InChIKey is MHWGIAQEEAXCMN-UHFFFAOYSA-N. The full InChI is InChI=1S/2Cs.H2O4Se/c;;1-5(2,3)4/h;;(H2,1,2,3,4).
What are the key properties of CID 170843432?
CID 170843432 has a molecular weight of 410.78 g/mol, XLogP of -2.49, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 170843432 is sourced from PubChem (CID 170843432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).