methyl 6-bromo-4-(4-ethoxyphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
Chemical Structure Depiction of
methyl 6-bromo-4-(4-ethoxyphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
methyl 6-bromo-4-(4-ethoxyphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
Compound characteristics
| Compound ID: | G917-0229 |
| Compound Name: | methyl 6-bromo-4-(4-ethoxyphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate |
| Molecular Weight: | 438.29 |
| Molecular Formula: | C18 H16 Br N O5 S |
| Smiles: | CCOc1ccc(cc1)N1C=C(C(=O)OC)S(c2ccc(cc12)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3302 |
| logD: | 3.3302 |
| logSw: | -3.8042 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.248 |
| InChI Key: | FDHLIQTXCLWTEY-UHFFFAOYSA-N |