azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane

H9N2O2PS2 — CID 175740324

IUPACazane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane
SMILESN.N.OP(O)(=S)S
InChIInChI=1S/2H3N.H3O2PS2/c;;1-3(2,4)5/h2*1H3;(H3,1,2,4,5)
InChIKeyCHZHAPAXHCWTPY-UHFFFAOYSA-N
MW164.19 g/mol
LogP0.45
Rot. Bonds

About azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane

azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane (PubChem CID 175740324) has the molecular formula H9N2O2PS2 and a molecular weight of 164.19 g/mol. Its IUPAC name is azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane.

Molecular Properties

Compound Nameazane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane
PubChem CID175740324
Molecular FormulaH9N2O2PS2
Molecular Weight164.19 g/mol
Exact Mass163.98
IUPAC Nameazane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane
SMILESN.N.OP(O)(=S)S
InChIInChI=1S/2H3N.H3O2PS2/c;;1-3(2,4)5/h2*1H3;(H3,1,2,4,5)
InChIKeyCHZHAPAXHCWTPY-UHFFFAOYSA-N
XLogP0.45
TPSA110.46 Ų
H-Bond Donors5
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.19
LogP ≤ 50.45
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane?
The IUPAC name of azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane (CID 175740324) is azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane.
What is the SMILES notation for azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane?
The canonical SMILES for azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane is N.N.OP(O)(=S)S.
What is the InChIKey of azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane?
The InChIKey is CHZHAPAXHCWTPY-UHFFFAOYSA-N. The full InChI is InChI=1S/2H3N.H3O2PS2/c;;1-3(2,4)5/h2*1H3;(H3,1,2,4,5).
What are the key properties of azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane?
azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane has a molecular weight of 164.19 g/mol, XLogP of 0.45, 0 rotatable bonds, 5 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane is sourced from PubChem (CID 175740324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).