2-(2-methylanilino)-2-oxoethyl 4-[1,1-dioxo-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate
Chemical Structure Depiction of
2-(2-methylanilino)-2-oxoethyl 4-[1,1-dioxo-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate
2-(2-methylanilino)-2-oxoethyl 4-[1,1-dioxo-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate
Compound characteristics
| Compound ID: | F475-0389 |
| Compound Name: | 2-(2-methylanilino)-2-oxoethyl 4-[1,1-dioxo-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate |
| Molecular Weight: | 519.5 |
| Molecular Formula: | C24 H20 F3 N3 O5 S |
| Smiles: | Cc1ccccc1NC(COC(c1ccc(cc1)C1Nc2cc(ccc2S(N1)(=O)=O)C(F)(F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8117 |
| logD: | 3.8115 |
| logSw: | -4.0137 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.41 |
| InChI Key: | XZDSXIFBQMRBDS-QFIPXVFZSA-N |