N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(3-phenylpropyl)-4-(trifluoromethyl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(3-phenylpropyl)-4-(trifluoromethyl)benzamide--trifluoroacetic acid (1/1)
N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(3-phenylpropyl)-4-(trifluoromethyl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F915-0711 |
| Compound Name: | N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(3-phenylpropyl)-4-(trifluoromethyl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 547.5 |
| Molecular Formula: | C23 H26 F3 N3 O2 |
| Salt: | CF3COOH |
| Smiles: | C(Cc1ccccc1)CN(CC(N1CCNCC1)=O)C(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.845 |
| logD: | 2.2855 |
| logSw: | -3.3413 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.509 |
| InChI Key: | XKFOCJHLXTWZPE-UHFFFAOYSA-N |