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N-[(5-bromo-2-ethoxyphenyl)methylideneamino]-2-(4-phenylmethoxyphenoxy)propanamide

HCID 178779792
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Basic information

CAS
339059-14-2
Standard SMILES
CCOc1ccc(Br)cc1C=NNC(=O)C(C)Oc1ccc(OCc2ccccc2)cc1
InChIKey
VRCSAQTUYOTSMI-UHFFFAOYSA-N
Molecular formula
C25H25BrN2O4
Average molar mass
497.4 g/mol

Names & identifiers

Preferred name
N-[(5-bromo-2-ethoxyphenyl)methylideneamino]-2-(4-phenylmethoxyphenoxy)propanamide
IUPAC
N-[(5-bromo-2-ethoxyphenyl)methylideneamino]-2-(4-phenylmethoxyphenoxy)propanamide
English name
2-[4-(benzyloxy)phenoxy]-N'-(5-bromo-2-ethoxybenzylidene)propanohydrazide
Molecular formula
C25H25BrN2O4
Molecular weight
497.38

Names & synonyms

2-[4-(benzyloxy)phenoxy]-N'-(5-bromo-2-ethoxybenzylidene)propanohydrazide

Database identifiers

CAS
339059-14-2

Properties

Computed structural properties

XLogP
5.8
Topological polar surface area
69.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
10
Heavy atoms
32
Formal charge
0
Complexity
576

Physicochemical properties

Density
1.288 · 1.288±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
pka
11.851 · 11.851±0.46(predicted)

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