diazene;sulfamide

H6N4O2S — CID 160757597

IUPACdiazene;sulfamide
SMILESNS(N)(=O)=O.[H]/N=N/[H]
InChIInChI=1S/H4N2O2S.H2N2/c1-5(2,3)4;1-2/h(H4,1,2,3,4);1-2H/b;2-1+
InChIKeyRXQDQHIHMSSCCN-WLHGVMLRSA-N
MW126.14 g/mol
LogP-1.26
Rot. Bonds

About diazene;sulfamide

diazene;sulfamide (PubChem CID 160757597) has the molecular formula H6N4O2S and a molecular weight of 126.14 g/mol. Its IUPAC name is diazene;sulfamide.

Molecular Properties

Compound Namediazene;sulfamide
PubChem CID160757597
Molecular FormulaH6N4O2S
Molecular Weight126.14 g/mol
Exact Mass126.02
IUPAC Namediazene;sulfamide
SMILESNS(N)(=O)=O.[H]/N=N/[H]
InChIInChI=1S/H4N2O2S.H2N2/c1-5(2,3)4;1-2/h(H4,1,2,3,4);1-2H/b;2-1+
InChIKeyRXQDQHIHMSSCCN-WLHGVMLRSA-N
XLogP-1.26
TPSA133.88 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.14
LogP ≤ 5-1.26
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

CID 11126239
CID 11126239
(Sulfonylamino)diazene
CID 19001728
Hydrazinesulfonohydrazide
CID 21092707
CID 21956258
CID 21956258
CID 87468166
CID 87468166
CID 150130934
CID 150130934
CID 151502670
CID 151502670
CID 152403038
CID 152403038
CID 161350897
CID 161350897
CID 173047107
CID 173047107
N-iminoazaniumylidenesulfamate
CID 173296523
Diazenylsulfonyldiazene
CID 173501811

Frequently Asked Questions

What is the IUPAC name of diazene;sulfamide?
The IUPAC name of diazene;sulfamide (CID 160757597) is diazene;sulfamide.
What is the SMILES notation for diazene;sulfamide?
The canonical SMILES for diazene;sulfamide is NS(N)(=O)=O.[H]/N=N/[H].
What is the InChIKey of diazene;sulfamide?
The InChIKey is RXQDQHIHMSSCCN-WLHGVMLRSA-N. The full InChI is InChI=1S/H4N2O2S.H2N2/c1-5(2,3)4;1-2/h(H4,1,2,3,4);1-2H/b;2-1+.
What are the key properties of diazene;sulfamide?
diazene;sulfamide has a molecular weight of 126.14 g/mol, XLogP of -1.26, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for diazene;sulfamide is sourced from PubChem (CID 160757597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).