2-(2-Imino-benzothiazol-3-yl)-1-(4-pyrrolidin-1-yl-phenyl)-ethanone hydrobromide salt

HCID 11618584
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Basic information

Standard SMILES
Br.N=c1sc2ccccc2n1CC(=O)c1ccc(N2CCCC2)cc1
InChIKey
ISGSNUPZDUYBPB-UHFFFAOYSA-N
Molecular formula
C19H20BrN3OS
Average molar mass
418.4 g/mol
Monoisotopic mass
417.05105

Names & identifiers

Preferred name
2-(2-Imino-benzothiazol-3-yl)-1-(4-pyrrolidin-1-yl-phenyl)-ethanone hydrobromide salt
IUPAC
2-(2-imino-1,3-benzothiazol-3-yl)-1-(4-pyrrolidin-1-ylphenyl)ethanone;hydrobromide

Names & synonyms

SCHEMBL3868794ISGSNUPZDUYBPB-UHFFFAOYSA-N2-(2-Imino-benzothiazol-3-yl)-1-(4-pyrrolidin-1-yl-phenyl)-ethanone hydrobromide salt

Database identifiers

PubChem CID
11618584

Properties

Computed structural properties

Topological polar surface area
72.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
25

Related reactions

1 records
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Compound notes

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