Basic information
- Standard SMILES
O=C1N(c2ccc(OC(F)(F)F)cc2)CCC12CCN(S(=O)(=O)Cl)CC2- InChIKey
QJSOLYZBOKTDQN-UHFFFAOYSA-N- Molecular formula
- C15H16ClF3N2O4S
- Average molar mass
- 412.8 g/mol
Names & identifiers
- Preferred name
- 1-Oxo-2-(4-trifluoromethoxy-phenyl)-2,8-diaza-spiro[4.5]decane-8-sulfonyl chloride
- IUPAC
- 1-oxo-2-[4-(trifluoromethoxy)phenyl]-2,8-diazaspiro[4.5]decane-8-sulfonyl chloride
Names & synonyms
1-Oxo-2-(4-trifluoromethoxy-phenyl)-2,8-diaza-spiro[4.5]decane-8-sulfonyl chlorideSCHEMBL746001
Database identifiers
- PubChem CID
- 86647653
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 636
Related reactions
28 records
Compound notes
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