3-acetamido-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-acetamido-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
3-acetamido-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F594-0576 |
| Compound Name: | 3-acetamido-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 543.59 |
| Molecular Formula: | C23 H35 N5 O3 |
| Salt: | CF3COOH |
| Smiles: | CCN1CCCC1CN(CCC(N1CCNCC1)=O)C(c1cccc(c1)NC(C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.4367 |
| logD: | -1.2646 |
| logSw: | -1.8055 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.678 |
| InChI Key: | IZEOGQRUXOOHDV-OAQYLSRUSA-N |