[4-(2,5-dimethylphenyl)piperazin-1-yl]{4-[(2-fluorophenyl)methanesulfonyl]-3-nitrophenyl}methanone
Chemical Structure Depiction of
[4-(2,5-dimethylphenyl)piperazin-1-yl]{4-[(2-fluorophenyl)methanesulfonyl]-3-nitrophenyl}methanone
[4-(2,5-dimethylphenyl)piperazin-1-yl]{4-[(2-fluorophenyl)methanesulfonyl]-3-nitrophenyl}methanone
Compound characteristics
| Compound ID: | K781-1844 |
| Compound Name: | [4-(2,5-dimethylphenyl)piperazin-1-yl]{4-[(2-fluorophenyl)methanesulfonyl]-3-nitrophenyl}methanone |
| Molecular Weight: | 511.57 |
| Molecular Formula: | C26 H26 F N3 O5 S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(c1ccc(c(c1)[N+]([O-])=O)S(Cc1ccccc1F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1231 |
| logD: | 5.123 |
| logSw: | -5.0606 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.691 |
| InChI Key: | FPPKOIKADQRXTO-UHFFFAOYSA-N |