3,4,5-trimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3,4,5-trimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
3,4,5-trimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F594-0828 |
| Compound Name: | 3,4,5-trimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 576.61 |
| Molecular Formula: | C24 H38 N4 O5 |
| Salt: | CF3COOH |
| Smiles: | COc1cc(cc(c1OC)OC)C(N(CCCN1CCCC1)CCC(N1CCNCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.0015 |
| logD: | -2.7013 |
| logSw: | -1.1949 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.814 |
| InChI Key: | JAGPUNITLHBYGS-UHFFFAOYSA-N |