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2-(o-Methoxyphenylthio)methylthiazolidine

HCID 10037362
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccccc1SCC1NCCS1
InChIKey
SIOOUTMFEKWDEA-UHFFFAOYSA-N
Molecular formula
C11H15NOS2
Average molar mass
241.4 g/mol
Monoisotopic mass
241.05950645

Names & identifiers

Preferred name
2-(o-Methoxyphenylthio)methylthiazolidine
IUPAC
2-[(2-methoxyphenyl)sulfanylmethyl]-1,3-thiazolidine

Names & synonyms

SCHEMBL9639820SIOOUTMFEKWDEA-UHFFFAOYSA-N2-(o-methoxyphenylthio)methylthiazolidine2-(o-methoxyphenylthio)methyl-thiazolidine

Database identifiers

PubChem CID
10037362

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
71.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
15
Formal charge
0
Complexity
191

Related reactions

3 records
New reaction record
HRID 137428 reaction equation
HRID 137428As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 1722835 reaction equation
HRID 1722835As reactantuspto-grants-1989_08
HRID 2291918 reaction equation
HRID 2291918As reactantuspto-grants-1989_01

Compound notes

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