(2,5-dimethylphenyl)methyl 4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzoate
Chemical Structure Depiction of
(2,5-dimethylphenyl)methyl 4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzoate
(2,5-dimethylphenyl)methyl 4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzoate
Compound characteristics
| Compound ID: | F475-0192 |
| Compound Name: | (2,5-dimethylphenyl)methyl 4-(1,1-dioxo-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: | Cc1ccc(C)c(COC(c2ccc(cc2)C2Nc3ccccc3S(N2)(=O)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.551 |
| logD: | 4.5509 |
| logSw: | -4.3864 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.958 |
| InChI Key: | NAXKGTSFKHOKJE-QFIPXVFZSA-N |