3,4,5-trimethoxy-N-(2-methylpropyl)-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3,4,5-trimethoxy-N-(2-methylpropyl)-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
3,4,5-trimethoxy-N-(2-methylpropyl)-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F594-0721 |
| Compound Name: | 3,4,5-trimethoxy-N-(2-methylpropyl)-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 521.53 |
| Molecular Formula: | C21 H33 N3 O5 |
| Salt: | CF3COOH |
| Smiles: | CC(C)CN(CCC(N1CCNCC1)=O)C(c1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7158 |
| logD: | -0.1122 |
| logSw: | -1.7301 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.759 |
| InChI Key: | QPDXMILVVBISJC-UHFFFAOYSA-N |