3-chloro-4-fluoro-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylpropyl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-chloro-4-fluoro-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylpropyl)benzamide--trifluoroacetic acid (1/1)
3-chloro-4-fluoro-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylpropyl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F915-0544 |
| Compound Name: | 3-chloro-4-fluoro-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylpropyl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 531.93 |
| Molecular Formula: | C22 H25 Cl F N3 O2 |
| Salt: | CF3COOH |
| Smiles: | CC(CN(CC(N1CCNCC1)=O)C(c1ccc(c(c1)[Cl])F)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6553 |
| logD: | 2.0958 |
| logSw: | -3.679 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.531 |
| InChI Key: | OUCWHRZYHLQAIS-INIZCTEOSA-N |