methyl 4-[1,1-dioxo-2-(2-phenylethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate
Chemical Structure Depiction of
methyl 4-[1,1-dioxo-2-(2-phenylethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate
methyl 4-[1,1-dioxo-2-(2-phenylethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate
Compound characteristics
| Compound ID: | F475-0765 |
| Compound Name: | methyl 4-[1,1-dioxo-2-(2-phenylethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C23 H22 N2 O4 S |
| Smiles: | COC(c1ccc(cc1)C1Nc2ccccc2S(N1CCc1ccccc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.432 |
| logD: | 4.432 |
| logSw: | -4.2582 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.188 |
| InChI Key: | GBSLDPARPBTKJF-QFIPXVFZSA-N |