3,4-difluoro-N-[(4-fluorophenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3,4-difluoro-N-[(4-fluorophenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
3,4-difluoro-N-[(4-fluorophenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F594-0509 |
| Compound Name: | 3,4-difluoro-N-[(4-fluorophenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 519.44 |
| Molecular Formula: | C21 H22 F3 N3 O2 |
| Salt: | CF3COOH |
| Smiles: | C(CN(Cc1ccc(cc1)F)C(c1ccc(c(c1)F)F)=O)C(N1CCNCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4293 |
| logD: | 0.6013 |
| logSw: | -2.1173 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.509 |
| InChI Key: | UVDAMZZSKSBMBS-UHFFFAOYSA-N |