5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-N-(2,4-dichlorophenyl)-2-fluorobenzamide
Chemical Structure Depiction of
5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-N-(2,4-dichlorophenyl)-2-fluorobenzamide
5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-N-(2,4-dichlorophenyl)-2-fluorobenzamide
Compound characteristics
| Compound ID: | K781-7859 |
| Compound Name: | 5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-N-(2,4-dichlorophenyl)-2-fluorobenzamide |
| Molecular Weight: | 566.43 |
| Molecular Formula: | C25 H22 Cl2 F N3 O5 S |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)S(c1ccc(c(c1)C(Nc1ccc(cc1[Cl])[Cl])=O)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8642 |
| logD: | 3.3802 |
| logSw: | -4.9237 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.999 |
| InChI Key: | MPHSMWCELFGQLR-UHFFFAOYSA-N |