thiadiazolidine 1,1-dioxide;hydrochloride

C2H7ClN2O2S — CID 140569796

IUPACthiadiazolidine 1,1-dioxide;hydrochloride
SMILESCl.O=S1(=O)CCNN1
InChIInChI=1S/C2H6N2O2S.ClH/c5-7(6)2-1-3-4-7;/h3-4H,1-2H2;1H
InChIKeySCBXMOATHGDVID-UHFFFAOYSA-N
MW158.61 g/mol
LogP-1.15
Rot. Bonds

About thiadiazolidine 1,1-dioxide;hydrochloride

thiadiazolidine 1,1-dioxide;hydrochloride (PubChem CID 140569796) has the molecular formula C2H7ClN2O2S and a molecular weight of 158.61 g/mol. Its IUPAC name is thiadiazolidine 1,1-dioxide;hydrochloride.

Molecular Properties

Compound Namethiadiazolidine 1,1-dioxide;hydrochloride
PubChem CID140569796
Molecular FormulaC2H7ClN2O2S
Molecular Weight158.61 g/mol
Exact Mass157.99
IUPAC Namethiadiazolidine 1,1-dioxide;hydrochloride
SMILESCl.O=S1(=O)CCNN1
InChIInChI=1S/C2H6N2O2S.ClH/c5-7(6)2-1-3-4-7;/h3-4H,1-2H2;1H
InChIKeySCBXMOATHGDVID-UHFFFAOYSA-N
XLogP-1.15
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.61
LogP ≤ 5-1.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of thiadiazolidine 1,1-dioxide;hydrochloride?
The IUPAC name of thiadiazolidine 1,1-dioxide;hydrochloride (CID 140569796) is thiadiazolidine 1,1-dioxide;hydrochloride.
What is the SMILES notation for thiadiazolidine 1,1-dioxide;hydrochloride?
The canonical SMILES for thiadiazolidine 1,1-dioxide;hydrochloride is Cl.O=S1(=O)CCNN1.
What is the InChIKey of thiadiazolidine 1,1-dioxide;hydrochloride?
The InChIKey is SCBXMOATHGDVID-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6N2O2S.ClH/c5-7(6)2-1-3-4-7;/h3-4H,1-2H2;1H.
What are the key properties of thiadiazolidine 1,1-dioxide;hydrochloride?
thiadiazolidine 1,1-dioxide;hydrochloride has a molecular weight of 158.61 g/mol, XLogP of -1.15, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for thiadiazolidine 1,1-dioxide;hydrochloride is sourced from PubChem (CID 140569796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).