N-[3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propyl]-4-fluoro-N-(4-methoxyphenyl)benzamide
Chemical Structure Depiction of
N-[3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propyl]-4-fluoro-N-(4-methoxyphenyl)benzamide
N-[3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propyl]-4-fluoro-N-(4-methoxyphenyl)benzamide
Compound characteristics
| Compound ID: | 0423-0500 |
| Compound Name: | N-[3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propyl]-4-fluoro-N-(4-methoxyphenyl)benzamide |
| Molecular Weight: | 482.51 |
| Molecular Formula: | C29 H23 F N2 O4 |
| Smiles: | COc1ccc(cc1)N(CCCN1C(c2cccc3cccc(C1=O)c23)=O)C(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0519 |
| logD: | 5.0519 |
| logSw: | -5.3335 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.977 |
| InChI Key: | GPTMMKULFUBPQE-UHFFFAOYSA-N |