2-{2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione
Chemical Structure Depiction of
2-{2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione
2-{2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione
Compound characteristics
| Compound ID: | 5067-3077 |
| Compound Name: | 2-{2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C23 H21 N3 O3 S |
| Smiles: | C1CN(CCN1CCN1C(c2cccc3cccc(C1=O)c23)=O)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8923 |
| logD: | 2.8922 |
| logSw: | -3.711 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.289 |
| InChI Key: | QGGVVYBXZKYFEZ-UHFFFAOYSA-N |