methyl 3-{[1,1-dioxo-6-(trifluoromethyl)-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]methyl}-4-methoxybenzoate
Chemical Structure Depiction of
methyl 3-{[1,1-dioxo-6-(trifluoromethyl)-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]methyl}-4-methoxybenzoate
methyl 3-{[1,1-dioxo-6-(trifluoromethyl)-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]methyl}-4-methoxybenzoate
Compound characteristics
| Compound ID: | K261-1667 |
| Compound Name: | methyl 3-{[1,1-dioxo-6-(trifluoromethyl)-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]methyl}-4-methoxybenzoate |
| Molecular Weight: | 428.38 |
| Molecular Formula: | C18 H15 F3 N2 O5 S |
| Smiles: | COC(c1ccc(c(CN2C=NS(c3ccc(cc23)C(F)(F)F)(=O)=O)c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.539 |
| logD: | 3.539 |
| logSw: | -3.8998 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.27 |
| InChI Key: | WZTLBGXFSJDSFU-UHFFFAOYSA-N |