Basic information
- Standard SMILES
COC(=O)N(Cc1cc(C#N)cc(C(F)(F)F)c1)Cc1cc(C(F)(F)F)ccc1-c1cc(C(C)C)ccc1OC- InChIKey
KGYGODXZFPTFLA-UHFFFAOYSA-N- Molecular formula
- C29H26F6N2O3
- Average molar mass
- 564.5 g/mol
Names & identifiers
- Preferred name
- Methyl[3-cyano-5-(trifluoromethyl)benzyl]{[5'-isopropyl-2'-methoxy-4-(trifluoromethyl)biphenyl-2-yl]methyl}carbamate
- IUPAC
- methyl N-[[3-cyano-5-(trifluoromethyl)phenyl]methyl]-N-[[2-(2-methoxy-5-propan-2-ylphenyl)-5-(trifluoromethyl)phenyl]methyl]carbamate
Names & synonyms
methyl[3-cyano-5-(trifluoromethyl)benzyl]{[5'-isopropyl-2'-methoxy-4-(trifluoromethyl)biphenyl-2-yl]methyl}carbamateSCHEMBL3551818
Database identifiers
- PubChem CID
- 11664112
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 62.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 8
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 885
Related reactions
6 records
Compound notes
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