2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide

C8H18N2O4S — CID 59779705

IUPAC2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide
SMILESCOCCN1CCN(CCOC)S1(=O)=O
InChIInChI=1S/C8H18N2O4S/c1-13-7-5-9-3-4-10(6-8-14-2)15(9,11)12/h3-8H2,1-2H3
InChIKeySTRXTGCZTONPDI-UHFFFAOYSA-N
MW238.31 g/mol
LogP-0.86
Rot. Bonds6

About 2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide

2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide (PubChem CID 59779705) has the molecular formula C8H18N2O4S and a molecular weight of 238.31 g/mol. Its IUPAC name is 2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide.

Molecular Properties

Compound Name2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide
PubChem CID59779705
Molecular FormulaC8H18N2O4S
Molecular Weight238.31 g/mol
Exact Mass238.10
IUPAC Name2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide
SMILESCOCCN1CCN(CCOC)S1(=O)=O
InChIInChI=1S/C8H18N2O4S/c1-13-7-5-9-3-4-10(6-8-14-2)15(9,11)12/h3-8H2,1-2H3
InChIKeySTRXTGCZTONPDI-UHFFFAOYSA-N
XLogP-0.86
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 5-0.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide?
The IUPAC name of 2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide (CID 59779705) is 2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide.
What is the SMILES notation for 2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide?
The canonical SMILES for 2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide is COCCN1CCN(CCOC)S1(=O)=O.
What is the InChIKey of 2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide?
The InChIKey is STRXTGCZTONPDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O4S/c1-13-7-5-9-3-4-10(6-8-14-2)15(9,11)12/h3-8H2,1-2H3.
What are the key properties of 2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide?
2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide has a molecular weight of 238.31 g/mol, XLogP of -0.86, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(2-methoxyethyl)-1,2,5-thiadiazolidine 1,1-dioxide is sourced from PubChem (CID 59779705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).