5-bromo-2-(2,4-dimethylanilino)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Chemical Structure Depiction of
5-bromo-2-(2,4-dimethylanilino)-1H-benzo[de]isoquinoline-1,3(2H)-dione
5-bromo-2-(2,4-dimethylanilino)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Compound characteristics
| Compound ID: | Y500-0222 |
| Compound Name: | 5-bromo-2-(2,4-dimethylanilino)-1H-benzo[de]isoquinoline-1,3(2H)-dione |
| Molecular Weight: | 395.25 |
| Molecular Formula: | C20 H15 Br N2 O2 |
| Smiles: | Cc1ccc(c(C)c1)NN1C(c2cccc3cc(cc(C1=O)c23)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7285 |
| logD: | 2.1722 |
| logSw: | -5.2917 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.378 |
| InChI Key: | NQDGUUBOGXYOIP-UHFFFAOYSA-N |