Basic information
- Standard SMILES
O=C1N(CCCc2ccccc2)CCC12CCN(S(=O)(=O)c1ccccc1Cl)CC2- InChIKey
VEGBMSVRJPFHRT-UHFFFAOYSA-N- Molecular formula
- C23H27ClN2O3S
- Average molar mass
- 447 g/mol
- Monoisotopic mass
- 446.1430916
Names & identifiers
- Preferred name
- 8-(2-Chloro-benzenesulfonyl)-2-(3-phenyl-propyl)-2,8-diaza-spiro[4.5]decan-1-one
- IUPAC
- 8-(2-chlorophenyl)sulfonyl-2-(3-phenylpropyl)-2,8-diazaspiro[4.5]decan-1-one
Names & synonyms
SCHEMBL3746782VEGBMSVRJPFHRT-UHFFFAOYSA-N8-(2-Chloro-benzenesulfonyl)-2-(3-phenyl-propyl)-2,8-diaza-spiro[4.5]decan-1-one
Database identifiers
- PubChem CID
- 59577909
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 694
Related reactions
2 records
Compound notes
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