N-butyl-4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-butyl-4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
N-butyl-4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F594-0730 |
| Compound Name: | N-butyl-4-ethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 475.51 |
| Molecular Formula: | C20 H31 N3 O3 |
| Salt: | CF3COOH |
| Smiles: | CCCCN(CCC(N1CCNCC1)=O)C(c1ccc(cc1)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3942 |
| logD: | 0.5662 |
| logSw: | -2.0539 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.883 |
| InChI Key: | SXQSRVQPAXBVST-UHFFFAOYSA-N |