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1-Benzyloxy-3-(4-butylphenyl)urea (HCID 19967368)|Huagongshe
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Compound
1-Benzyloxy-3-(4-butylphenyl)urea
HCID
19967368
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
CCCCc1ccc(NC(=O)NOCc2ccccc2)cc1
InChIKey
ZWKAYQCHZCCQJT-UHFFFAOYSA-N
Molecular formula
C18H22N2O2
Average molar mass
298.4 g/mol
Names & identifiers
Preferred name
1-Benzyloxy-3-(4-butylphenyl)urea
IUPAC
1-(4-butylphenyl)-3-phenylmethoxyurea
Names & synonyms
SCHEMBL7617377
ZWKAYQCHZCCQJT-UHFFFAOYSA-N
1-benzyloxy-3-(4-butylphenyl)urea
Database identifiers
PubChem CID
19967368
Properties
Computed structural properties
XLogP
4.3
Topological polar surface area
50.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
7
Heavy atoms
22
Formal charge
0
Complexity
308
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Related reactions
3 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
300680
As product
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
976628
As product
uspto-grants-1997_03
HRID
976629
As reactant
uspto-grants-1997_03
Compound notes
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