N-cyclopentyl-3-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-cyclopentyl-3-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
N-cyclopentyl-3-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F594-0116 |
| Compound Name: | N-cyclopentyl-3-methyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 457.49 |
| Molecular Formula: | C20 H29 N3 O2 |
| Salt: | CF3COOH |
| Smiles: | Cc1cccc(c1)C(N(CCC(N1CCNCC1)=O)C1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6693 |
| logD: | 0.8414 |
| logSw: | -2.09 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.12 |
| InChI Key: | ZEEMHLKFOKZLJQ-UHFFFAOYSA-N |