5-bromo-2-{[4-(4-chlorophenoxy)anilino]methyl}-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
5-bromo-2-{[4-(4-chlorophenoxy)anilino]methyl}-1H-isoindole-1,3(2H)-dione
5-bromo-2-{[4-(4-chlorophenoxy)anilino]methyl}-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 0466-0235 |
| Compound Name: | 5-bromo-2-{[4-(4-chlorophenoxy)anilino]methyl}-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 457.71 |
| Molecular Formula: | C21 H14 Br Cl N2 O3 |
| Smiles: | C(Nc1ccc(cc1)Oc1ccc(cc1)[Cl])N1C(c2ccc(cc2C1=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.0277 |
| logD: | 6.0277 |
| logSw: | -6.2527 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.399 |
| InChI Key: | KCGQLDGDXJLZSG-UHFFFAOYSA-N |