Bis{3-[2-(diethylamino)ethoxy]phenyl}methanone
Basic information
- CAS
67588-09-4- Standard SMILES
CCN(CC)CCOc1cccc(C(=O)c2cccc(OCCN(CC)CC)c2)c1- InChIKey
TWNRAYPQQCHECY-UHFFFAOYSA-N- Molecular formula
- C25H36N2O3
- Average molar mass
- 412.6 g/mol
- Monoisotopic mass
- 412.27259301
Names & identifiers
- Preferred name
- Bis{3-[2-(diethylamino)ethoxy]phenyl}methanone
- IUPAC
- bis[3-[2-(diethylamino)ethoxy]phenyl]methanone
Names & synonyms
CHEMBL1950132Bis{3-[2-(diethylamino)ethoxy]phenyl}methanone67588-09-4DTXSID20498627BDBM50364901
Database identifiers
- CAS
67588-09-4- PubChem CID
- 12445992
- DTXSID
DTXSID20498627- ChEMBL
CHEMBL1950132
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 14
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 425
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Related reactions
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Compound notes
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