4-oxo-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinoxaline-7-carboxylic acid
Chemical Structure Depiction of
4-oxo-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinoxaline-7-carboxylic acid
4-oxo-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinoxaline-7-carboxylic acid
Compound characteristics
Compound ID: | FF01-3307 |
Compound Name: | 4-oxo-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinoxaline-7-carboxylic acid |
Molecular Weight: | 232.24 |
Molecular Formula: | C12 H12 N2 O3 |
Smiles: | C1CC2C(Nc3cc(ccc3N2C1)C(O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.5945 |
logD: | -0.2999 |
logSw: | -2.0286 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 56.341 |
InChI Key: | ILCIRRSQEUVMSA-JTQLQIEISA-N |