methyl [4-(acetyloxy)-3-benzoyl-1,1-dioxo-1lambda~6~,2-benzothiazin-2(1H)-yl]acetate
Chemical Structure Depiction of
methyl [4-(acetyloxy)-3-benzoyl-1,1-dioxo-1lambda~6~,2-benzothiazin-2(1H)-yl]acetate
methyl [4-(acetyloxy)-3-benzoyl-1,1-dioxo-1lambda~6~,2-benzothiazin-2(1H)-yl]acetate
Compound characteristics
| Compound ID: | D239-0130 |
| Compound Name: | methyl [4-(acetyloxy)-3-benzoyl-1,1-dioxo-1lambda~6~,2-benzothiazin-2(1H)-yl]acetate |
| Molecular Weight: | 415.42 |
| Molecular Formula: | C20 H17 N O7 S |
| Smiles: | CC(=O)OC1=C(C(c2ccccc2)=O)N(CC(=O)OC)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1659 |
| logD: | 2.1659 |
| logSw: | -2.8976 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 87.058 |
| InChI Key: | ZUIGFVTWCRDJRR-UHFFFAOYSA-N |