Basic information
- Standard SMILES
CCCCOC(=O)C(CC)Oc1cccc(CNCCCOc2ccc(OC)cc2)c1- InChIKey
JGBBGSUMJLBUOD-UHFFFAOYSA-N- Molecular formula
- C25H35NO5
- Average molar mass
- 429.5 g/mol
Names & identifiers
- Preferred name
- Butyl 2-[3-[[3-(4-methoxyphenoxy)propylamino]methyl]phenoxy]butanoate
- IUPAC
- butyl 2-[3-[[3-(4-methoxyphenoxy)propylamino]methyl]phenoxy]butanoate
Database identifiers
- PubChem CID
- 76563598
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 16
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 467
Related reactions
1 records
Compound notes
Loading…