3,4-Dimethoxyphenyl 2-thiazolyl ketone

HCID 21189768
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Basic information

Standard SMILES
COc1ccc(C(=O)c2nccs2)cc1OC
InChIKey
OHDGIAJJEZSDTI-UHFFFAOYSA-N
Molecular formula
C12H11NO3S
Average molar mass
249.29 g/mol

Names & identifiers

Preferred name
3,4-Dimethoxyphenyl 2-thiazolyl ketone
IUPAC
(3,4-dimethoxyphenyl)-(1,3-thiazol-2-yl)methanone

Names & synonyms

SCHEMBL6588319OHDGIAJJEZSDTI-UHFFFAOYSA-N3,4-dimethoxyphenyl 2-thiazolyl ketone

Database identifiers

PubChem CID
21189768

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
76.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
17

Related reactions

2 records
New reaction record

Linked notes

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