4-acetamido-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-pentylbenzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-acetamido-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-pentylbenzamide--trifluoroacetic acid (1/1)
4-acetamido-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-pentylbenzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F594-0396 |
| Compound Name: | 4-acetamido-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-pentylbenzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 502.53 |
| Molecular Formula: | C21 H32 N4 O3 |
| Salt: | CF3COOH |
| Smiles: | CCCCCN(CCC(N1CCNCC1)=O)C(c1ccc(cc1)NC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8738 |
| logD: | 0.0459 |
| logSw: | -1.8721 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.021 |
| InChI Key: | CCSWSHFFXRXYJT-UHFFFAOYSA-N |