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3-bromo-N-[(4-methoxynaphthalen-1-yl)methylideneamino]benzamide

HCID 178697609
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Basic information

CAS
304479-50-3
Standard SMILES
COc1ccc(C=NNC(=O)c2cccc(Br)c2)c2ccccc12
InChIKey
IXLSZGSZTQLVSF-UHFFFAOYSA-N
Molecular formula
C19H15BrN2O2
Average molar mass
383.2 g/mol
Monoisotopic mass
382.03169

Names & identifiers

Preferred name
3-bromo-N-[(4-methoxynaphthalen-1-yl)methylideneamino]benzamide
IUPAC
3-bromo-N-[(4-methoxynaphthalen-1-yl)methylideneamino]benzamide
English name
3-bromo-N'-[(4-methoxy-1-naphthyl)methylene]benzohydrazide
Molecular formula
C19H15BrN2O2
Molecular weight
383.24

Names & synonyms

3-bromo-N'-[(4-methoxynaphthalen-1-yl)methylidene]benzohydrazide3-bromo-N'-[(4-methoxy-1-naphthyl)methylene]benzohydrazide3-bromo-N'-[(E)-(4-methoxynaphthalen-1-yl)methylidene]benzohydrazideBenzoic acid, 3-bromo-, 2-[(4-methoxy-1-naphthalenyl)methylene]hydrazide

Database identifiers

CAS
304479-50-3
PubChem CID
1010036

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
50.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
24
Formal charge
0
Complexity
457

Physicochemical properties

Density
1.37 · 1.37±0.1 g/cm3(Predicted)
pka
11.68 · 11.68±0.46(Predicted)

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