4-bromo-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-(propan-2-yl)benzamide
Chemical Structure Depiction of
4-bromo-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-(propan-2-yl)benzamide
4-bromo-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-(propan-2-yl)benzamide
Compound characteristics
| Compound ID: | F594-0197 |
| Compound Name: | 4-bromo-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-(propan-2-yl)benzamide |
| Molecular Weight: | 496.32 |
| Molecular Formula: | C17 H24 Br N3 O2 |
| Salt: | CF3COOH |
| Smiles: | CC(C)N(CCC(N1CCNCC1)=O)C(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 1.7695 |
| logD: | 0.9416 |
| logSw: | -2.1273 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.525 |
| InChI Key: | VXSSMNUTFFLENF-UHFFFAOYSA-N |