4-chloro-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[2-(piperidin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-chloro-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[2-(piperidin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1)
4-chloro-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[2-(piperidin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F594-0875 |
| Compound Name: | 4-chloro-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[2-(piperidin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 520.98 |
| Molecular Formula: | C21 H31 Cl N4 O2 |
| Salt: | CF3COOH |
| Smiles: | C1CCN(CC1)CCN(CCC(N1CCNCC1)=O)C(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 0.9684 |
| logD: | 0.1404 |
| logSw: | -2.624 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.47 |
| InChI Key: | TWYUWCJTCIDCNU-UHFFFAOYSA-N |