1-Oxa-3,9-diazaspiro(5.5)undecan-2-one, 9-(3-(p-fluorobenzoyl)propyl)-5-phenyl-, hydrochloride
Basic information
- CAS
54981-18-9- Standard SMILES
Cl.O=C1NC(c2ccccc2)CC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)O1- InChIKey
HCTBJOARGXIKTD-UHFFFAOYSA-N- Molecular formula
- C24H28ClFN2O3
- Average molar mass
- 446.9 g/mol
- Monoisotopic mass
- 446.1772486
Names & identifiers
- Preferred name
- 1-Oxa-3,9-diazaspiro(5.5)undecan-2-one, 9-(3-(p-fluorobenzoyl)propyl)-5-phenyl-, hydrochloride
- IUPAC
- 9-[4-(4-fluorophenyl)-4-oxobutyl]-4-phenyl-1-oxa-3,9-diazaspiro[5.5]undecan-2-one;hydrochloride
Names & synonyms
1-Oxa-3,9-diazaspiro(5.5)undecan-2-one, 9-(3-(p-fluorobenzoyl)propyl)-5-phenyl-, hydrochloride54981-18-9RefChem:232693DTXSID009703301-(4-Fluorophenyl)-4-(2-hydroxy-4-phenyl-1-oxa-3,9-diazaspiro[5.5]undec-2-en-9-yl)butan-1-one--hydrogen chloride (1/1)
Database identifiers
- CAS
54981-18-9- PubChem CID
- 108299
- DTXSID
DTXSID00970330
Properties
Computed structural properties
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 591
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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