3-Benzyl-1-phenyl-1,3,8-triazaspiro[4,5]decan-4-one Trifluoroacetate
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Basic information
- Standard SMILES
O=C(O)C(F)(F)F.O=C1N(Cc2ccccc2)CN(c2ccccc2)C12CCNCC2- InChIKey
RZBARFRFXZLSDV-UHFFFAOYSA-N- Molecular formula
- C22H24F3N3O3
- Average molar mass
- 435.4 g/mol
Names & identifiers
- Preferred name
- 3-Benzyl-1-phenyl-1,3,8-triazaspiro[4,5]decan-4-one Trifluoroacetate
- IUPAC
- 3-benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one;2,2,2-trifluoroacetic acid
Names & synonyms
3-Benzyl-1-phenyl-1,3,8-triazaspiro[4,5]decan-4-one TrifluoroacetateSCHEMBL6246951
Database identifiers
- PubChem CID
- 22380554
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 518
Related reactions
1 records
Compound notes
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