4-chloro-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylethyl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-chloro-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylethyl)benzamide--trifluoroacetic acid (1/1)
4-chloro-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylethyl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F915-0363 |
| Compound Name: | 4-chloro-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylethyl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 499.92 |
| Molecular Formula: | C21 H24 Cl N3 O2 |
| Salt: | CF3COOH |
| Smiles: | C(CN(CC(N1CCNCC1)=O)C(c1ccc(cc1)[Cl])=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.8891 |
| logD: | 1.3296 |
| logSw: | -2.8998 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.509 |
| InChI Key: | OPLHUFPVSUTKIS-UHFFFAOYSA-N |