Basic information
- Standard SMILES
CCOC(=O)c1ccc(NCCCCCCCCCCCCCCC(C)C)cc1- InChIKey
OQAXGOHDADWUOA-UHFFFAOYSA-N- Molecular formula
- C26H45NO2
- Average molar mass
- 403.6 g/mol
- Monoisotopic mass
- 403.34502968
Names & identifiers
- Preferred name
- Ethyl 4-(15-methylhexadecyl)aminobenzoate
- IUPAC
- ethyl 4-(15-methylhexadecylamino)benzoate
Names & synonyms
CHEMBL34394SCHEMBL11075084OQAXGOHDADWUOA-UHFFFAOYSA-Nethyl 4-(15-methylhexadecyl)aminobenzoate
Database identifiers
- PubChem CID
- 20437391
- ChEMBL
CHEMBL34394
Properties
Computed structural properties
- XLogP
- 10.7
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 19
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 375
Related reactions
9 records
Compound notes
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