4-methyl-N-[(4-methylphenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-methyl-N-[(4-methylphenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
4-methyl-N-[(4-methylphenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F594-0194 |
| Compound Name: | 4-methyl-N-[(4-methylphenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 493.53 |
| Molecular Formula: | C23 H29 N3 O2 |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(CN(CCC(N2CCNCC2)=O)C(c2ccc(C)cc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.9546 |
| logD: | 1.1267 |
| logSw: | -2.4448 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.509 |
| InChI Key: | BWMWPUNWSCIWSU-UHFFFAOYSA-N |