2-{5-[5-(butylsulfanyl)-1,3,4-oxadiazol-2-yl]pentyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione
Chemical Structure Depiction of
2-{5-[5-(butylsulfanyl)-1,3,4-oxadiazol-2-yl]pentyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione
2-{5-[5-(butylsulfanyl)-1,3,4-oxadiazol-2-yl]pentyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione
Compound characteristics
| Compound ID: | Y010-1504 |
| Compound Name: | 2-{5-[5-(butylsulfanyl)-1,3,4-oxadiazol-2-yl]pentyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione |
| Molecular Weight: | 423.53 |
| Molecular Formula: | C23 H25 N3 O3 S |
| Smiles: | CCCCSc1nnc(CCCCCN2C(c3cccc4cccc(C2=O)c34)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.8195 |
| logD: | 4.8195 |
| logSw: | -5.2269 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.867 |
| InChI Key: | BBPPEBSNJJZQFE-UHFFFAOYSA-N |