Basic information
- Standard SMILES
O=C(NS(=O)(=O)c1ccccc1)c1ccc(NCCCCCCCCCCCCCCCC(F)(F)F)cc1- InChIKey
JPKAXKUSAIGYTH-UHFFFAOYSA-N- Molecular formula
- C29H41F3N2O3S
- Average molar mass
- 554.7 g/mol
Names & identifiers
- Preferred name
- 4-[15-(Trifluoromethyl)pentadecylamino]-N-(phenylsulfonyl)benzamide
- IUPAC
- N-(benzenesulfonyl)-4-(16,16,16-trifluorohexadecylamino)benzamide
Names & synonyms
4-[15-(Trifluoromethyl)pentadecylamino]-N-(phenylsulfonyl)benzamideSCHEMBL11247193
Database identifiers
- PubChem CID
- 20549404
Properties
Computed structural properties
- XLogP
- 10.3
- Topological polar surface area
- 83.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 19
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 726
Related reactions
5 records
Compound notes
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