Basic information
- Standard SMILES
CC(O)(c1ccc(N2CCC3(CCN(S(=O)(=O)C4CC4)CC3)C2=O)cc1)C(F)(F)F- InChIKey
LIJKOEJTQAASSH-UHFFFAOYSA-N- Molecular formula
- C20H25F3N2O4S
- Average molar mass
- 446.5 g/mol
Names & identifiers
- Preferred name
- 8-(Cyclopropylsulfonyl)-2-(4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenyl)-2,8-diazaspiro[4.5]decan-1-one
- IUPAC
- 8-cyclopropylsulfonyl-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenyl]-2,8-diazaspiro[4.5]decan-1-one
Names & synonyms
8-(Cyclopropylsulfonyl)-2-(4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenyl)-2,8-diazaspiro[4.5]decan-1-oneSCHEMBL3738938
Database identifiers
- PubChem CID
- 59577975
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 86.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 777
Related reactions
2 records
Compound notes
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