Basic information
- Standard SMILES
CS(=O)(=O)c1ccc(N2CCN(C(=O)c3c(F)ccc(S(C)(=O)=O)c3F)CC2)c(F)c1- InChIKey
CLDCYSKFCXSIQN-UHFFFAOYSA-N- Molecular formula
- C19H19F3N2O5S2
- Average molar mass
- 476.5 g/mol
Names & identifiers
- Preferred name
- (2,6-Difluoro-3-methanesulfonyl-phenyl)-[4-(2-fluoro-4-methanesulfonyl-phenyl)-piperazin-1-yl]-methanone
- IUPAC
- (2,6-difluoro-3-methylsulfonylphenyl)-[4-(2-fluoro-4-methylsulfonylphenyl)piperazin-1-yl]methanone
Names & synonyms
SCHEMBL4421735CLDCYSKFCXSIQN-UHFFFAOYSA-N(2,6-Difluoro-3-methanesulfonyl-phenyl)-[4-(2-fluoro-4-methanesulfonyl-phenyl)-piperazin-1-yl]-methanone
Database identifiers
- PubChem CID
- 69037451
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 866
Related reactions
10 records
Compound notes
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