N-(2-{4-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}phenyl)-2-methylpropanamide
Chemical Structure Depiction of
N-(2-{4-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}phenyl)-2-methylpropanamide
N-(2-{4-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}phenyl)-2-methylpropanamide
Compound characteristics
| Compound ID: | J059-0211 |
| Compound Name: | N-(2-{4-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}phenyl)-2-methylpropanamide |
| Molecular Weight: | 492.94 |
| Molecular Formula: | C26 H22 Cl F N4 O3 |
| Smiles: | CC(C)C(Nc1ccccc1C1C(N(CC(Nc2ccc(c(c2)[Cl])F)=O)c2ccccc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5835 |
| logD: | 4.5749 |
| logSw: | -4.6296 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.993 |
| InChI Key: | YRYGAPLHZQKWCX-UHFFFAOYSA-N |