Basic information
- Standard SMILES
Cc1cnn(-c2ccc(S(C)(=O)=O)cc2C(=O)N2CCN(c3ccc(S(C)(=O)=O)cc3F)CC2)c1- InChIKey
WUSMHWGLFBPZQV-UHFFFAOYSA-N- Molecular formula
- C23H25FN4O5S2
- Average molar mass
- 520.6 g/mol
- Monoisotopic mass
- 520.12504042
Names & identifiers
- Preferred name
- [4-(2-Fluoro-4-methanesulfonyl-phenyl)-piperazin-1-yl]-[5-methanesulfonyl-2-(4-methyl-pyrazol-1-yl)-phenyl]-methanone
- IUPAC
- [4-(2-fluoro-4-methylsulfonylphenyl)piperazin-1-yl]-[2-(4-methylpyrazol-1-yl)-5-methylsulfonylphenyl]methanone
Names & synonyms
SCHEMBL3920070WUSMHWGLFBPZQV-UHFFFAOYSA-N[4-(2-Fluoro-4-methanesulfonyl-phenyl)-piperazin-1-yl]-[5-methanesulfonyl-2-(4-methyl-pyrazol-1-yl)-phenyl]-methanone
Database identifiers
- PubChem CID
- 68839738
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 975
Related reactions
2 records
Compound notes
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