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4-Butoxy-N-(2-(2-(1-naphthylmethylene)hydrazino)-2-oxoethyl)benzamide

HCID 9607590
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Basic information

CAS
880057-73-8
Standard SMILES
CCCCOc1ccc(C(=O)NCC(=O)N/N=C/c2cccc3ccccc23)cc1
InChIKey
PCFXNAUKINSVAZ-WGOQTCKBSA-N
Molecular formula
C24H25N3O3
Average molar mass
403.5 g/mol
Monoisotopic mass
403.18959167

Names & identifiers

Preferred name
4-Butoxy-N-(2-(2-(1-naphthylmethylene)hydrazino)-2-oxoethyl)benzamide
IUPAC
4-butoxy-N-[2-[(2E)-2-(naphthalen-1-ylmethylidene)hydrazinyl]-2-oxoethyl]benzamide
English name
4-Butoxy-N-(2-(2-(1-naphthylmethylene)hydrazino)-2-oxoethyl)benzamide
Molecular formula
C24H25N3O3
Molecular weight
403.47

Names & synonyms

AKOS0243994654-BUTOXY-N-(2-(2-(1-NAPHTHYLMETHYLENE)HYDRAZINO)-2-OXOETHYL)BENZAMIDEGlycine, N-(4-butoxybenzoyl)-, 2-(1-naphthalenylmethylene)hydrazide

Database identifiers

CAS
880057-73-8
PubChem CID
9607590
EC Number
145-774-1

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
79.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
9
Heavy atoms
30
Formal charge
0
Complexity
572

Physicochemical properties

Density
1.161 · 1.161±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
pka
12.21 · 12.210±0.46(predicted)

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