ethyl 4-[2-(4-methylbenzoyl)-1,1-dioxo-1lambda~6~,4-benzothiazin-4(1H)-yl]benzoate
Chemical Structure Depiction of
ethyl 4-[2-(4-methylbenzoyl)-1,1-dioxo-1lambda~6~,4-benzothiazin-4(1H)-yl]benzoate
ethyl 4-[2-(4-methylbenzoyl)-1,1-dioxo-1lambda~6~,4-benzothiazin-4(1H)-yl]benzoate
Compound characteristics
| Compound ID: | F390-0077 |
| Compound Name: | ethyl 4-[2-(4-methylbenzoyl)-1,1-dioxo-1lambda~6~,4-benzothiazin-4(1H)-yl]benzoate |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C25 H21 N O5 S |
| Smiles: | CCOC(c1ccc(cc1)N1C=C(C(c2ccc(C)cc2)=O)S(c2ccccc12)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.497 |
| logD: | 4.497 |
| logSw: | -4.2197 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.171 |
| InChI Key: | SMPWCWPBQYMDTF-UHFFFAOYSA-N |