4-butanoyl-3,4-dihydroquinoxalin-2(1H)-one
Chemical Structure Depiction of
4-butanoyl-3,4-dihydroquinoxalin-2(1H)-one
4-butanoyl-3,4-dihydroquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | D479-0246 |
| Compound Name: | 4-butanoyl-3,4-dihydroquinoxalin-2(1H)-one |
| Molecular Weight: | 218.25 |
| Molecular Formula: | C12 H14 N2 O2 |
| Smiles: | CCCC(N1CC(Nc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9133 |
| logD: | 1.912 |
| logSw: | -2.5186 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.129 |
| InChI Key: | BVTZQYUYEFTJRX-UHFFFAOYSA-N |