N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F594-0561 |
| Compound Name: | N-[(1-ethylpyrrolidin-2-yl)methyl]-3-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 500.56 |
| Molecular Formula: | C22 H34 N4 O2 |
| Salt: | CF3COOH |
| Smiles: | CCN1CCCC1CN(CCC(N1CCNCC1)=O)C(c1cccc(C)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4324 |
| logD: | -0.3956 |
| logSw: | -1.9598 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.416 |
| InChI Key: | YPQMEOWSJQMOFR-HXUWFJFHSA-N |