4-(2-(2-fluoroethylthio)benzo[d]thiazol-6-yl)-N-methylaniline

HCID 59282916
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Basic information

Standard SMILES
CNc1ccc(-c2ccc3nc(SCCF)sc3c2)cc1
InChIKey
WEHZMTVZXCNDGY-UHFFFAOYSA-N
Molecular formula
C16H15FN2S2
Average molar mass
318.4 g/mol
Monoisotopic mass
318.066069

Names & identifiers

Preferred name
4-(2-(2-fluoroethylthio)benzo[d]thiazol-6-yl)-N-methylaniline
IUPAC
4-[2-(2-fluoroethylsulfanyl)-1,3-benzothiazol-6-yl]-N-methylaniline

Names & synonyms

SCHEMBL1849292WEHZMTVZXCNDGY-UHFFFAOYSA-N4-(2-(2-fluoroethylthio)benzo[d]thiazol-6-yl)-N-methylaniline

Database identifiers

PubChem CID
59282916

Properties

Computed structural properties

XLogP
5.2
Topological polar surface area
78.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
21

Related reactions

1 records
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Compound notes

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