3,5-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3,5-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
3,5-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F594-0815 |
| Compound Name: | 3,5-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 514.59 |
| Molecular Formula: | C23 H36 N4 O2 |
| Salt: | CF3COOH |
| Smiles: | Cc1cc(C)cc(c1)C(N(CCCN1CCCC1)CCC(N1CCNCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0679 |
| logD: | -1.632 |
| logSw: | -1.5659 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.836 |
| InChI Key: | JIKDSRYDPHAKHO-UHFFFAOYSA-N |