N-benzyl-3,4-dimethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-benzyl-3,4-dimethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1)
N-benzyl-3,4-dimethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F915-0093 |
| Compound Name: | N-benzyl-3,4-dimethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 511.5 |
| Molecular Formula: | C22 H27 N3 O4 |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(cc1OC)C(N(CC(N1CCNCC1)=O)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5845 |
| logD: | 0.025 |
| logSw: | -2.0254 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.792 |
| InChI Key: | GEYSHKGOAJVHQH-UHFFFAOYSA-N |