3-(4-Benzyloxy-phenyl)-isothiazol-5-carboxylic acid methyl ester

HCID 66617751
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Basic information

Standard SMILES
COC(=O)c1cc(-c2ccc(OCc3ccccc3)cc2)ns1
InChIKey
WSYODCONDYGONX-UHFFFAOYSA-N
Molecular formula
C18H15NO3S
Average molar mass
325.4 g/mol

Names & identifiers

Preferred name
3-(4-Benzyloxy-phenyl)-isothiazol-5-carboxylic acid methyl ester
IUPAC
methyl 3-(4-phenylmethoxyphenyl)-1,2-thiazole-5-carboxylate

Names & synonyms

SCHEMBL190360WSYODCONDYGONX-UHFFFAOYSA-N3-(4-benzyloxy-phenyl)-isothiazol-5-carboxylic acid methyl ester

Database identifiers

PubChem CID
66617751

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
76.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
23

Related reactions

1 records
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Compound notes

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