N-[4-(4,5-Difluoro-2-methoxy-phenyl)-pyridin-3-yl]-3-fluoro-N-methyl-5-trifluoromethyl-benzamide
Basic information
- Standard SMILES
COc1cc(F)c(F)cc1-c1ccncc1N(C)C(=O)c1cc(F)cc(C(F)(F)F)c1- InChIKey
SIFAHOLWFIZHSU-UHFFFAOYSA-N- Molecular formula
- C21H14F6N2O2
- Average molar mass
- 440.3 g/mol
- Monoisotopic mass
- 440.09594667
Names & identifiers
- Preferred name
- N-[4-(4,5-Difluoro-2-methoxy-phenyl)-pyridin-3-yl]-3-fluoro-N-methyl-5-trifluoromethyl-benzamide
- IUPAC
- N-[4-(4,5-difluoro-2-methoxyphenyl)-3-pyridinyl]-3-fluoro-N-methyl-5-(trifluoromethyl)benzamide
Names & synonyms
N-[4-(4,5-Difluoro-2-methoxy-phenyl)-pyridin-3-yl]-3-fluoro-N-methyl-5-trifluoromethyl-benzamideCHEMBL6010439SCHEMBL12097738BDBM411134US10385022, Example 130
Database identifiers
- PubChem CID
- 86670751
- ChEMBL
CHEMBL6010439
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 621
Related reactions
2 records
Compound notes
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