Basic information
- Standard SMILES
COc1cc(NC(C)=O)c(Cl)cc1C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1- InChIKey
VDKUBSZJZMPPJU-UHFFFAOYSA-N- Molecular formula
- C18H13ClF6N2O3
- Average molar mass
- 454.7 g/mol
- Monoisotopic mass
- 454.0518889
Names & identifiers
- Preferred name
- 4-Acetylamino-N-[3,5-bis(trifluoromethyl)phenyl]-5-chloro-2-methoxybenzamide
- IUPAC
- 4-acetamido-N-[3,5-bis(trifluoromethyl)phenyl]-5-chloro-2-methoxybenzamide
Names & synonyms
4-Acetylamino-N-[3,5-bis(trifluoromethyl)phenyl]-5-chloro-2-methoxybenzamideSCHEMBL130029
Database identifiers
- PubChem CID
- 17860207
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 608
Related reactions
4 records
Compound notes
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