N-(2-{4-[2-(4-chloroanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-4-methylphenyl)propanamide
Chemical Structure Depiction of
N-(2-{4-[2-(4-chloroanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-4-methylphenyl)propanamide
N-(2-{4-[2-(4-chloroanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-4-methylphenyl)propanamide
Compound characteristics
| Compound ID: | D395-0125 |
| Compound Name: | N-(2-{4-[2-(4-chloroanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-4-methylphenyl)propanamide |
| Molecular Weight: | 474.95 |
| Molecular Formula: | C26 H23 Cl N4 O3 |
| Smiles: | CCC(Nc1ccc(C)cc1C1C(N(CC(Nc2ccc(cc2)[Cl])=O)c2ccccc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9381 |
| logD: | 3.938 |
| logSw: | -4.2564 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.779 |
| InChI Key: | IFJDZZHBSRXKIH-UHFFFAOYSA-N |