3-bromo-N-cycloheptyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide
Chemical Structure Depiction of
3-bromo-N-cycloheptyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide
3-bromo-N-cycloheptyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide
Compound characteristics
| Compound ID: | F594-0100 |
| Compound Name: | 3-bromo-N-cycloheptyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide |
| Molecular Weight: | 550.42 |
| Molecular Formula: | C21 H30 Br N3 O2 |
| Salt: | CF3COOH |
| Smiles: | C1CCCC(CC1)N(CCC(N1CCNCC1)=O)C(c1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2168 |
| logD: | 2.3889 |
| logSw: | -3.3322 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.085 |
| InChI Key: | MQLUEACFBAXJBV-UHFFFAOYSA-N |