Ethanesulfonic acid {2-[5-(7-fluoro-1-methyl-2-oxo-1,2,3,4-tetrahydro-quinolin-6-yl)-pyridin-3-yloxy]-ethyl}-methyl-amide
Basic information
- Standard SMILES
CCS(=O)(=O)N(C)CCOc1cncc(-c2cc3c(cc2F)N(C)C(=O)CC3)c1- InChIKey
IGPXHRUKQXFJBE-UHFFFAOYSA-N- Molecular formula
- C20H24FN3O4S
- Average molar mass
- 421.5 g/mol
- Monoisotopic mass
- 421.14715559
Names & identifiers
- Preferred name
- Ethanesulfonic acid {2-[5-(7-fluoro-1-methyl-2-oxo-1,2,3,4-tetrahydro-quinolin-6-yl)-pyridin-3-yloxy]-ethyl}-methyl-amide
- IUPAC
- N-[2-[[5-(7-fluoro-1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-3-pyridinyl]oxy]ethyl]-N-methylethanesulfonamide
Names & synonyms
SCHEMBL14789999SCHEMBL31260110IGPXHRUKQXFJBE-UHFFFAOYSA-NEthanesulfonic acid {2-[5-(7-fluoro-1-methyl-2-oxo-1,2,3,4-tetrahydro-quinolin-6-yl)-pyridin-3-yloxy]-ethyl}-methyl-amide
Database identifiers
- PubChem CID
- 86679232
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 88.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 671
Related reactions
1 records
Compound notes
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