N-(2-{4-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-4-methylphenyl)propanamide
Chemical Structure Depiction of
N-(2-{4-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-4-methylphenyl)propanamide
N-(2-{4-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-4-methylphenyl)propanamide
Compound characteristics
| Compound ID: | J059-0196 |
| Compound Name: | N-(2-{4-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-4-methylphenyl)propanamide |
| Molecular Weight: | 492.94 |
| Molecular Formula: | C26 H22 Cl F N4 O3 |
| Smiles: | CCC(Nc1ccc(C)cc1C1C(N(CC(Nc2ccc(c(c2)[Cl])F)=O)c2ccccc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0736 |
| logD: | 4.065 |
| logSw: | -4.3633 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.779 |
| InChI Key: | NHEXVGIKYUGYLR-UHFFFAOYSA-N |