N-(chlorosulfonylamino)sulfamoyl chloride

H2Cl2N2O4S2 — CID 151023962

IUPACN-(chlorosulfonylamino)sulfamoyl chloride
SMILESO=S(=O)(Cl)NNS(=O)(=O)Cl
InChIInChI=1S/Cl2H2N2O4S2/c1-9(5,6)3-4-10(2,7)8/h3-4H
InChIKeyLYQRSWFOVGNFEI-UHFFFAOYSA-N
MW229.07 g/mol
LogP-0.95
Rot. Bonds3

About N-(chlorosulfonylamino)sulfamoyl chloride

N-(chlorosulfonylamino)sulfamoyl chloride (PubChem CID 151023962) has the molecular formula H2Cl2N2O4S2 and a molecular weight of 229.07 g/mol. Its IUPAC name is N-(chlorosulfonylamino)sulfamoyl chloride.

Molecular Properties

Compound NameN-(chlorosulfonylamino)sulfamoyl chloride
PubChem CID151023962
Molecular FormulaH2Cl2N2O4S2
Molecular Weight229.07 g/mol
Exact Mass227.88
IUPAC NameN-(chlorosulfonylamino)sulfamoyl chloride
SMILESO=S(=O)(Cl)NNS(=O)(=O)Cl
InChIInChI=1S/Cl2H2N2O4S2/c1-9(5,6)3-4-10(2,7)8/h3-4H
InChIKeyLYQRSWFOVGNFEI-UHFFFAOYSA-N
XLogP-0.95
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.07
LogP ≤ 5-0.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(chlorosulfonylamino)sulfamoyl chloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(chlorosulfonylamino)sulfamoyl chloride?
The IUPAC name of N-(chlorosulfonylamino)sulfamoyl chloride (CID 151023962) is N-(chlorosulfonylamino)sulfamoyl chloride.
What is the SMILES notation for N-(chlorosulfonylamino)sulfamoyl chloride?
The canonical SMILES for N-(chlorosulfonylamino)sulfamoyl chloride is O=S(=O)(Cl)NNS(=O)(=O)Cl.
What is the InChIKey of N-(chlorosulfonylamino)sulfamoyl chloride?
The InChIKey is LYQRSWFOVGNFEI-UHFFFAOYSA-N. The full InChI is InChI=1S/Cl2H2N2O4S2/c1-9(5,6)3-4-10(2,7)8/h3-4H.
What are the key properties of N-(chlorosulfonylamino)sulfamoyl chloride?
N-(chlorosulfonylamino)sulfamoyl chloride has a molecular weight of 229.07 g/mol, XLogP of -0.95, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(chlorosulfonylamino)sulfamoyl chloride is sourced from PubChem (CID 151023962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).