4-(2H-1,3-benzodioxol-5-yl)-2-(2,4-dimethylbenzoyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-(2H-1,3-benzodioxol-5-yl)-2-(2,4-dimethylbenzoyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione
4-(2H-1,3-benzodioxol-5-yl)-2-(2,4-dimethylbenzoyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | F390-0475 |
| Compound Name: | 4-(2H-1,3-benzodioxol-5-yl)-2-(2,4-dimethylbenzoyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
| Molecular Weight: | 451.47 |
| Molecular Formula: | C24 H18 F N O5 S |
| Smiles: | Cc1ccc(C(C2=CN(c3ccc4c(c3)OCO4)c3cc(ccc3S2(=O)=O)F)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.5875 |
| logD: | 4.5875 |
| logSw: | -4.4712 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.533 |
| InChI Key: | PGZMGNOARFGFSV-UHFFFAOYSA-N |