Basic information
- Standard SMILES
CCOC(=O)c1cnc(N2CCc3ccccc32)nc1OCc1ccc(OC(F)(F)F)cc1- InChIKey
PALABGRVORXNFM-UHFFFAOYSA-N- Molecular formula
- C23H20F3N3O4
- Average molar mass
- 459.4 g/mol
Names & identifiers
- Preferred name
- ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-{[4-(trifluoromethoxy)benzyl]oxy}-5-pyrimidinecarboxylate
- IUPAC
- ethyl 2-(2,3-dihydroindol-1-yl)-4-[[4-(trifluoromethoxy)phenyl]methoxy]pyrimidine-5-carboxylate
Names & synonyms
ethyl 2-(2,3-dihydro-1H-indol-1-yl)-4-{[4-(trifluoromethoxy)benzyl]oxy}-5-pyrimidinecarboxylateSCHEMBL5752676
Database identifiers
- PubChem CID
- 21990327
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 73.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 8
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 645
Related reactions
2 records
Compound notes
Loading…