Basic information
- Standard SMILES
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)Cc1ccc(S(C)(=O)=O)cc1- InChIKey
NQDIANYUJRNNIC-UHFFFAOYSA-N- Molecular formula
- C18H19F3N2O5S2
- Average molar mass
- 464.5 g/mol
- Monoisotopic mass
- 464.06874854
Names & identifiers
- Preferred name
- N-(2-Ethylamino-5-trifluoromethanesulfonyl-phenyl)-2-(4-methanesulfonyl-phenyl)-acetamide
- IUPAC
- N-[2-(ethylamino)-5-(trifluoromethylsulfonyl)phenyl]-2-(4-methylsulfonylphenyl)acetamide
Names & synonyms
N-(2-Ethylamino-5-trifluoromethanesulfonyl-phenyl)-2-(4-methanesulfonyl-phenyl)-acetamideSCHEMBL6001778
Database identifiers
- PubChem CID
- 9956080
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 795
Related reactions
2 records
Compound notes
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