propyl 4-(5-bromo-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzoate
Chemical Structure Depiction of
propyl 4-(5-bromo-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzoate
propyl 4-(5-bromo-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzoate
Compound characteristics
| Compound ID: | 8010-2430 |
| Compound Name: | propyl 4-(5-bromo-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzoate |
| Molecular Weight: | 438.28 |
| Molecular Formula: | C22 H16 Br N O4 |
| Smiles: | CCCOC(c1ccc(cc1)N1C(c2cccc3cc(cc(C1=O)c23)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2216 |
| logD: | 5.2216 |
| logSw: | -5.8283 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.29 |
| InChI Key: | MGEHYEOHNXORDJ-UHFFFAOYSA-N |