2-(4-(2-Fluorophenyl)-2,3-dioxo-3,4-dihydropyrazin-1(2H)-yl)acetic acid
Basic information
- CAS
1707734-98-2- Standard SMILES
O=C(O)Cn1ccn(-c2ccccc2F)c(=O)c1=O- InChIKey
SNGYSWUKZQZRJQ-UHFFFAOYSA-N- Molecular formula
- C12H9FN2O4
- Average molar mass
- 264.21 g/mol
- Monoisotopic mass
- 264.05463493
Names & identifiers
- Preferred name
- 2-(4-(2-Fluorophenyl)-2,3-dioxo-3,4-dihydropyrazin-1(2H)-yl)acetic acid
- IUPAC
- 2-[4-(2-fluorophenyl)-2,3-dioxopyrazin-1-yl]acetic acid
Names & synonyms
1707734-98-22-(4-(2-Fluorophenyl)-2,3-dioxo-3,4-dihydropyrazin-1(2H)-yl)acetic acid2-[4-(2-fluorophenyl)-2,3-dioxo-1,2,3,4-tetrahydropyrazin-1-yl]acetic acidDTXSID001159096[4-(2-Fluoro-phenyl)-2,3-dioxo-3,4-dihydro-2H-pyrazin-1-yl]-acetic acid[4-(2-Fluorophenyl)-2,3-dioxo-3,4-dihydropyrazin-1(2H)-yl]acetic acid1(2H)-Pyrazineacetic acid, 4-(2-fluorophenyl)-3,4-dihydro-2,3-dioxo-2-(4-(2-Fluorophenyl)-2,3-dioxo-3,4-dihydropyrazin-1(2H)-yl)aceticacid
Database identifiers
- CAS
1707734-98-2- PubChem CID
- 97619645
- DTXSID
DTXSID001159096
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 77.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 437
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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