3-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-4-fluoro-N-(2-methylphenyl)benzamide
Chemical Structure Depiction of
3-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-4-fluoro-N-(2-methylphenyl)benzamide
3-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-4-fluoro-N-(2-methylphenyl)benzamide
Compound characteristics
| Compound ID: | K781-6182 |
| Compound Name: | 3-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-4-fluoro-N-(2-methylphenyl)benzamide |
| Molecular Weight: | 481.59 |
| Molecular Formula: | C26 H28 F N3 O3 S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)S(c1cc(ccc1F)C(Nc1ccccc1C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1965 |
| logD: | 5.1919 |
| logSw: | -4.9824 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.302 |
| InChI Key: | TVWJTXVMYLGPRI-UHFFFAOYSA-N |