Basic information
- Standard SMILES
CCOC(=O)C1=C(C(C)C)NC(C(C)C)=C(c2ccccc2)C1c1ccc(F)cc1- InChIKey
WRSNJGHUMBPXGG-UHFFFAOYSA-N- Molecular formula
- C26H30FNO2
- Average molar mass
- 407.5 g/mol
- Monoisotopic mass
- 407.22605736
Names & identifiers
- Preferred name
- Ethyl 1,4-dihydro-2,6-diisopropyl-4-(4-fluorophenyl)-5-phenyl-pyridine-3-carboxylate
- IUPAC
- ethyl 4-(4-fluorophenyl)-5-phenyl-2,6-di(propan-2-yl)-1,4-dihydropyridine-3-carboxylate
Names & synonyms
SCHEMBL9270856WRSNJGHUMBPXGG-UHFFFAOYSA-NEthyl 1,4-dihydro-2,6-diisopropyl-4-(4-fluorophenyl)-5-phenyl-pyridine-3-carboxylate
Database identifiers
- PubChem CID
- 20081859
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 665
Related reactions
3 records
Compound notes
Loading…