1-Oxa-3,9-diazaspiro(5.5)undecan-2-one, 5-ethyl-9-(3-(p-chlorobenzoyl)propyl)-
Basic information
- CAS
54981-21-4- Standard SMILES
CCC1CC2(CCN(CCCC(=O)c3ccc(Cl)cc3)CC2)OC(=O)N1- InChIKey
VIDAVEJTWOLBOO-UHFFFAOYSA-N- Molecular formula
- C20H27ClN2O3
- Average molar mass
- 378.9 g/mol
- Monoisotopic mass
- 378.1710204
Names & identifiers
- Preferred name
- 1-Oxa-3,9-diazaspiro(5.5)undecan-2-one, 5-ethyl-9-(3-(p-chlorobenzoyl)propyl)-
- IUPAC
- 9-[4-(4-chlorophenyl)-4-oxobutyl]-4-ethyl-1-oxa-3,9-diazaspiro[5.5]undecan-2-one
- English name
- 5-Ethyl-9-[3-(p-chlorobenzoyl)propyl]-1-oxa-3,9-diazaspiro[5.5]undecan-2-one
- Molecular formula
- C20H27ClN2O3
- Molecular weight
- 378.89
Names & synonyms
BRN 056689954981-21-41-Oxa-3,9-diazaspiro(5.5)undecan-2-one, 5-ethyl-9-(3-(p-chlorobenzoyl)propyl)-Oxo-2 ethyl-5 ((chloro-4 benzoyl)-3 propyl)-9 oxadiaza-1,3,9 spiro(5,5)undecane [French]Oxo-2 ethyl-5 ((chloro-4 benzoyl)-3 propyl)-9 oxadiaza-1,3,9 spiro(5,5)undecaneRefChem:232687DTXSID209703321-(4-Chlorophenyl)-4-(4-ethyl-2-hydroxy-1-oxa-3,9-diazaspiro[5.5]undec-2-en-9-yl)butan-1-one5-Ethyl-9-[3-(p-chlorobenzoyl)propyl]-1-oxa-3,9-diazaspiro[5.5]undecan-2-one1-Oxa-3,9-diazaspiro[5.5]undecan-2-one, 9-[4-(4-chlorophenyl)-4-oxobutyl]-5-ethyl-
Database identifiers
- CAS
54981-21-4- PubChem CID
- 108302
- DTXSID
DTXSID20970332
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 497
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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