Basic information
- Standard SMILES
C=CCN1C(=O)[C@H](CC)N(S(=O)(=O)c2ccc(O)cc2)c2cc(F)ccc21- InChIKey
CYZICDGJXFDCNV-INIZCTEOSA-N- Molecular formula
- C19H19FN2O4S
- Average molar mass
- 390.4 g/mol
Names & identifiers
- Preferred name
- (3S)-1-allyl-3-ethyl-6-fluoro-4-[(4-hydroxyphenyl)sulfonyl]-3,4-dihydroquinoxalin-2(1H)-one
- IUPAC
- (3S)-3-ethyl-6-fluoro-4-(4-hydroxyphenyl)sulfonyl-1-prop-2-enyl-3H-quinoxalin-2-one
Names & synonyms
SCHEMBL4865611CYZICDGJXFDCNV-INIZCTEOSA-N(3S)-1-allyl-3-ethyl-6-fluoro-4-[(4-hydroxyphenyl)sulfonyl]-3,4-dihydroquinoxalin-2(1H)-one
Database identifiers
- PubChem CID
- 11625290
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 86.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 657
Related reactions
1 records
Compound notes
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