N-[6-(3-aminophenoxy)-7-cyano-1,3-benzothiazol-2-yl]acetamide

HCID 86644686
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Basic information

Standard SMILES
CC(=O)Nc1nc2ccc(Oc3cccc(N)c3)c(C#N)c2s1
InChIKey
CKQKUBUEBCYJBI-UHFFFAOYSA-N
Molecular formula
C16H12N4O2S
Average molar mass
324.4 g/mol
Monoisotopic mass
324.06809681

Names & identifiers

Preferred name
N-[6-(3-aminophenoxy)-7-cyano-1,3-benzothiazol-2-yl]acetamide
IUPAC
N-[6-(3-aminophenoxy)-7-cyano-1,3-benzothiazol-2-yl]acetamide

Names & synonyms

SCHEMBL825992CKQKUBUEBCYJBI-UHFFFAOYSA-NN-[6-(3-aminophenoxy)-7-cyano-1,3-benzothiazol-2-yl]acetamide

Database identifiers

PubChem CID
86644686

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
129 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
23

Related reactions

39 records
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Compound notes

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