3-(3,4-Dimethoxyphenyl)-N-(6-fluoro-4-quinolinyl)-2-propenamide
Basic information
- CAS
1018144-22-3- Standard SMILES
COc1ccc(C=CC(=O)Nc2ccnc3ccc(F)cc23)cc1OC- InChIKey
COQVSJRPSGWJPF-UHFFFAOYSA-N- Molecular formula
- C20H17FN2O3
- Average molar mass
- 352.4 g/mol
- Monoisotopic mass
- 352.12232057
Names & identifiers
- Preferred name
- 3-(3,4-Dimethoxyphenyl)-N-(6-fluoro-4-quinolinyl)-2-propenamide
- IUPAC
- 3-(3,4-dimethoxyphenyl)-N-(6-fluoroquinolin-4-yl)prop-2-enamide
Names & synonyms
DTXSID1011764113-(3,4-Dimethoxyphenyl)-N-(6-fluoro-4-quinolinyl)-2-propenamide3-(3,4-Dimethoxyphenyl)-N-(6-fluoroquinolin-4-yl)prop-2-enamide1018144-22-3
Database identifiers
- CAS
1018144-22-3- PubChem CID
- 74666376
- DTXSID
DTXSID101176411
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 60.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 501
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