3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one
Chemical Structure Depiction of
3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one
3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one
Compound characteristics
| Compound ID: | IB09-3240 |
| Compound Name: | 3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one |
| Molecular Weight: | 439.49 |
| Molecular Formula: | C24 H26 F N3 O4 |
| Smiles: | COc1cc2CC(N(CC(N3CCN(CC3)c3ccc(cc3)F)=O)C=Cc2cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.74 |
| logD: | 1.74 |
| logSw: | -2.66 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 101.25 |
| InChI Key: | QWCXEFUYJLMTNP-UHFFFAOYSA-N |