(6-Bromobenzo[d]isothiazol-3-yl)(4-chlorophenyl)methanone

HCID 67436732
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Basic information

Standard SMILES
O=C(c1ccc(Cl)cc1)c1nsc2cc(Br)ccc12
InChIKey
BWDSZVCOWFNSMH-UHFFFAOYSA-N
Molecular formula
C14H7BrClNOS
Average molar mass
352.6 g/mol
Monoisotopic mass
350.91203

Names & identifiers

Preferred name
(6-Bromobenzo[d]isothiazol-3-yl)(4-chlorophenyl)methanone
IUPAC
(6-bromo-1,2-benzothiazol-3-yl)-(4-chlorophenyl)methanone

Names & synonyms

SCHEMBL2518631(6-bromobenzo[d]isothiazol-3-yl)(4-chlorophenyl)methanoneBWDSZVCOWFNSMH-UHFFFAOYSA-N1171245-20-7DB-120619

Database identifiers

PubChem CID
67436732

Properties

Computed structural properties

XLogP
5.3
Topological polar surface area
58.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
19

Related reactions

4 records
New reaction record

Compound notes

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