N-(1-benzylpiperidin-4-yl)-4-chloro-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-4-chloro-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1)
N-(1-benzylpiperidin-4-yl)-4-chloro-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F915-0585 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-4-chloro-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 569.02 |
| Molecular Formula: | C25 H31 Cl N4 O2 |
| Salt: | CF3COOH |
| Smiles: | C1CN(CCC1N(CC(N1CCNCC1)=O)C(c1ccc(cc1)[Cl])=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5043 |
| logD: | 1.5255 |
| logSw: | -3.3336 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.316 |
| InChI Key: | FKMMJEZZFUYKNX-UHFFFAOYSA-N |