5-[(2,4-dimethylbenzene-1-sulfonyl)amino]-2-[4-(4-fluorophenyl)piperazin-1-yl]benzoic acid
Chemical Structure Depiction of
5-[(2,4-dimethylbenzene-1-sulfonyl)amino]-2-[4-(4-fluorophenyl)piperazin-1-yl]benzoic acid
5-[(2,4-dimethylbenzene-1-sulfonyl)amino]-2-[4-(4-fluorophenyl)piperazin-1-yl]benzoic acid
Compound characteristics
| Compound ID: | F290-0338 |
| Compound Name: | 5-[(2,4-dimethylbenzene-1-sulfonyl)amino]-2-[4-(4-fluorophenyl)piperazin-1-yl]benzoic acid |
| Molecular Weight: | 483.56 |
| Molecular Formula: | C25 H26 F N3 O4 S |
| Smiles: | Cc1ccc(c(C)c1)S(Nc1ccc(c(c1)C(O)=O)N1CCN(CC1)c1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4311 |
| logD: | 3.3155 |
| logSw: | -5.1714 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.708 |
| InChI Key: | PACOQHJCLRAFTN-UHFFFAOYSA-N |