Basic information
- CAS
5686-48-6- Standard SMILES
COc1ccc(CNC(=O)COc2ccc(OC)cc2)cc1- InChIKey
WTBWEJYHDCSHMT-UHFFFAOYSA-N- Molecular formula
- C17H19NO4
- Average molar mass
- 301.34 g/mol
- Monoisotopic mass
- 301.13140809
Names & identifiers
- Preferred name
- N-(4-methoxybenzyl)-2-(4-methoxyphenoxy)acetamide
- IUPAC
- 2-(4-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide
Names & synonyms
N-(4-methoxybenzyl)-2-(4-methoxyphenoxy)acetamide5686-48-62-(4-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]acetamideCBMicro_027901Cambridge id 5686486Oprea1_863293MLS001196506CHEMBL1699321DTXSID70972285HMS2873E14STK071654AKOS001653886
Show more names
SMR000556109BIM-0028005.P001AB00093507-01SR-01000496679SR-01000496679-1(4-Methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]ethanimidic acid2-(4-Methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]ethanimidic acid
Database identifiers
- CAS
5686-48-6- PubChem CID
- 748751
- DTXSID
DTXSID70972285- ChEMBL
CHEMBL1699321
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 321
Experimental & physicochemical properties
Solubility35.8 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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