4-fluoro-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-{3-[(propan-2-yl)oxy]propyl}benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-fluoro-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-{3-[(propan-2-yl)oxy]propyl}benzamide--trifluoroacetic acid (1/1)
4-fluoro-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-{3-[(propan-2-yl)oxy]propyl}benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F915-0678 |
| Compound Name: | 4-fluoro-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-{3-[(propan-2-yl)oxy]propyl}benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 479.47 |
| Molecular Formula: | C19 H28 F N3 O3 |
| Salt: | CF3COOH |
| Smiles: | CC(C)OCCCN(CC(N1CCNCC1)=O)C(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4288 |
| logD: | -0.1307 |
| logSw: | -1.8426 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.982 |
| InChI Key: | XBHLCXRDEUYBMK-UHFFFAOYSA-N |