1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Chemical Structure Depiction of
1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Compound characteristics
| Compound ID: | E647-0297 |
| Compound Name: | 1-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one |
| Molecular Weight: | 381.45 |
| Molecular Formula: | C22 H24 F N3 O2 |
| Smiles: | C1CC(N(CC(N2CCN(CC2)c2ccc(cc2)F)=O)c2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3052 |
| logD: | 3.3052 |
| logSw: | -3.5329 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.603 |
| InChI Key: | RQFDQBUPCVEQMH-UHFFFAOYSA-N |