N-(3-methoxypropyl)-3,5-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(3-methoxypropyl)-3,5-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
N-(3-methoxypropyl)-3,5-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F594-0668 |
| Compound Name: | N-(3-methoxypropyl)-3,5-dimethyl-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: | Cc1cc(C)cc(c1)C(N(CCCOC)CCC(N1CCNCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7403 |
| logD: | -0.0877 |
| logSw: | -1.4159 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.102 |
| InChI Key: | ZFQOABKWOYWJJU-UHFFFAOYSA-N |