Basic information
- Standard SMILES
COC(=O)C(c1cn(Cc2ccc(Cl)cc2)c2ccccc12)N(C)Cc1cccc(C(F)(F)F)c1- InChIKey
LBPZTDZEAMJEBU-UHFFFAOYSA-N- Molecular formula
- C27H24ClF3N2O2
- Average molar mass
- 500.9 g/mol
Names & identifiers
- Preferred name
- Methyl alpha-[N-methyl-3-(trifluoromethyl)benzylamino]-1-(4-chlorobenzyl)indole-3-acetate
- IUPAC
- methyl 2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-[methyl-[[3-(trifluoromethyl)phenyl]methyl]amino]acetate
Names & synonyms
Methyl alpha-[N-methyl-3-(trifluoromethyl)benzylamino]-1-(4-chlorobenzyl)indole-3-acetateSCHEMBL9584098
Database identifiers
- PubChem CID
- 19796715
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 34.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 700
Related reactions
1 records
Compound notes
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