Basic information
- Standard SMILES
COC(=O)N(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Cc1cc(C(F)(F)F)ccc1C(OC)C1CCCCC1- InChIKey
FJQWZAVLAQFTLQ-UHFFFAOYSA-N- Molecular formula
- C27H28F9NO3
- Average molar mass
- 585.5 g/mol
Names & identifiers
- Preferred name
- (3,5-Bis-trifluoromethyl-benzyl)-[2-(cyclohexyl-methoxy-methyl)-5-trifluoromethyl-benzyl]-carbamic acid methyl ester
- IUPAC
- methyl N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-[[2-[cyclohexyl(methoxy)methyl]-5-(trifluoromethyl)phenyl]methyl]carbamate
Names & synonyms
(3,5-Bis-trifluoromethyl-benzyl)-[2-(cyclohexyl-methoxy-methyl)-5-trifluoromethyl-benzyl]-carbamic acid methyl esterSCHEMBL1601779
Database identifiers
- PubChem CID
- 58968645
Properties
Computed structural properties
- XLogP
- 7.8
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 8
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 789
Related reactions
2 records
Compound notes
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