Basic information
- CAS
63815-49-6- Standard SMILES
CCC(=O)c1ccc(OCC(O)CN2CCC(O)(c3ccccc3)CC2)cc1- InChIKey
VBQYVPWJXQKIMF-UHFFFAOYSA-N- Molecular formula
- C23H29NO4
- Average molar mass
- 383.5 g/mol
- Monoisotopic mass
- 383.20965841
Names & identifiers
- Preferred name
- 1-{4-[2-Hydroxy-3-(4-hydroxy-4-phenylpiperidin-1-yl)propoxy]phenyl}propan-1-one
- IUPAC
- 1-[4-[2-hydroxy-3-(4-hydroxy-4-phenylpiperidin-1-yl)propoxy]phenyl]propan-1-one
Names & synonyms
1-{4-[2-hydroxy-3-(4-hydroxy-4-phenylpiperidin-1-yl)propoxy]phenyl}propan-1-one63815-49-61-[4-[2-hydroxy-3-(4-hydroxy-4-phenylpiperidin-1-yl)propoxy]phenyl]propan-1-oneBRN 1509054NSC1478473-(4-Hydroxy-4-phenylpiperino)-1-(4-propionylphenoxy)propan-2-ol4'-(2-Hydroxy-3-(4-hydroxy-4-phenylpiperidino)propoxy)propiophenonePropiophenone, 4'-(2-hydroxy-3-(4-hydroxy-4-phenylpiperidino)propoxy)-DTXSID40980392AKOS033557806NSC 147847NSC-147847
Show more names
1-Propanone, 1-[4-[2-hydroxy-3-(4-hydroxy-4-phenyl-1-piperidinyl)propoxy]phenyl]-Z1700508490
Database identifiers
- CAS
63815-49-6- PubChem CID
- 98936
- DTXSID
DTXSID40980392
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 70 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 475
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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