N-{4-[2-(4-chloro-2-methylanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-N-methylpropanamide
Chemical Structure Depiction of
N-{4-[2-(4-chloro-2-methylanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-N-methylpropanamide
N-{4-[2-(4-chloro-2-methylanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-N-methylpropanamide
Compound characteristics
| Compound ID: | J056-0110 |
| Compound Name: | N-{4-[2-(4-chloro-2-methylanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-N-methylpropanamide |
| Molecular Weight: | 412.87 |
| Molecular Formula: | C21 H21 Cl N4 O3 |
| Smiles: | CCC(N(C)C1C(N(CC(Nc2ccc(cc2C)[Cl])=O)c2ccccc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9026 |
| logD: | 2.9024 |
| logSw: | -3.2923 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.332 |
| InChI Key: | WYQNABDZEIOXQB-UHFFFAOYSA-N |