6-{5-[(4-chloro-2-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1-(2-methylpropyl)-1,4-dihydroquinoxaline-2,3-dione
Chemical Structure Depiction of
6-{5-[(4-chloro-2-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1-(2-methylpropyl)-1,4-dihydroquinoxaline-2,3-dione
6-{5-[(4-chloro-2-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1-(2-methylpropyl)-1,4-dihydroquinoxaline-2,3-dione
Compound characteristics
| Compound ID: | F542-0874 |
| Compound Name: | 6-{5-[(4-chloro-2-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1-(2-methylpropyl)-1,4-dihydroquinoxaline-2,3-dione |
| Molecular Weight: | 440.89 |
| Molecular Formula: | C22 H21 Cl N4 O4 |
| Smiles: | CC(C)CN1C(C(Nc2cc(ccc12)c1nc(COc2ccc(cc2C)[Cl])on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7511 |
| logD: | 5.7321 |
| logSw: | -5.918 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.227 |
| InChI Key: | KIMBRLGNXHYNLO-UHFFFAOYSA-N |