4-tert-butyl-N-[(4-fluorophenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide
Chemical Structure Depiction of
4-tert-butyl-N-[(4-fluorophenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide
4-tert-butyl-N-[(4-fluorophenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide
Compound characteristics
| Compound ID: | F594-0502 |
| Compound Name: | 4-tert-butyl-N-[(4-fluorophenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide |
| Molecular Weight: | 539.57 |
| Molecular Formula: | C25 H32 F N3 O2 |
| Salt: | CF3COOH |
| Smiles: | CC(C)(C)c1ccc(cc1)C(N(CCC(N1CCNCC1)=O)Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9314 |
| logD: | 2.1034 |
| logSw: | -3.1767 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.509 |
| InChI Key: | HKNQHEBBDRQRBP-UHFFFAOYSA-N |