4-[2-(1-octanoyl-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)acetamido]benzoic acid
Chemical Structure Depiction of
4-[2-(1-octanoyl-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)acetamido]benzoic acid
4-[2-(1-octanoyl-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)acetamido]benzoic acid
Compound characteristics
| Compound ID: | 4483-3382 |
| Compound Name: | 4-[2-(1-octanoyl-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)acetamido]benzoic acid |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C25 H29 N3 O5 |
| Smiles: | CCCCCCCC(N1C(CC(Nc2ccc(cc2)C(O)=O)=O)C(Nc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5206 |
| logD: | 2.1254 |
| logSw: | -4.2173 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.662 |
| InChI Key: | UQIWPQBPZJNIPN-NRFANRHFSA-N |