N-(2-methylpropyl)-3-(4-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)propanamide
Chemical Structure Depiction of
N-(2-methylpropyl)-3-(4-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)propanamide
N-(2-methylpropyl)-3-(4-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)propanamide
Compound characteristics
| Compound ID: | L866-2482 |
| Compound Name: | N-(2-methylpropyl)-3-(4-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)propanamide |
| Molecular Weight: | 452.57 |
| Molecular Formula: | C24 H28 N4 O3 S |
| Smiles: | CC(C)CNC(CCC1C(N(CC(Nc2cccc(c2)SC)=O)c2ccccc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9191 |
| logD: | 2.9191 |
| logSw: | -3.4836 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.974 |
| InChI Key: | RODMQAYNGWKVMD-UHFFFAOYSA-N |