N-(1-benzylpiperidin-4-yl)-3,5-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-3,5-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
N-(1-benzylpiperidin-4-yl)-3,5-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F594-0590 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-3,5-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 576.66 |
| Molecular Formula: | C28 H38 N4 O2 |
| Salt: | CF3COOH |
| Smiles: | Cc1cc(C)cc(c1)C(N(CCC(N1CCNCC1)=O)C1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9397 |
| logD: | 1.81 |
| logSw: | -3.3021 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.294 |
| InChI Key: | BFPBONILMFAIKK-UHFFFAOYSA-N |