(3-methylphenyl)methyl 4-{2-[(2-methylphenyl)methyl]-1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl}benzoate
Chemical Structure Depiction of
(3-methylphenyl)methyl 4-{2-[(2-methylphenyl)methyl]-1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl}benzoate
(3-methylphenyl)methyl 4-{2-[(2-methylphenyl)methyl]-1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl}benzoate
Compound characteristics
| Compound ID: | K261-3153 |
| Compound Name: | (3-methylphenyl)methyl 4-{2-[(2-methylphenyl)methyl]-1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl}benzoate |
| Molecular Weight: | 512.63 |
| Molecular Formula: | C30 H28 N2 O4 S |
| Smiles: | Cc1cccc(COC(c2ccc(cc2)C2Nc3ccccc3S(N2Cc2ccccc2C)(=O)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.2427 |
| logD: | 7.2427 |
| logSw: | -5.7306 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.893 |
| InChI Key: | UUXIWGCZRUERIW-LJAQVGFWSA-N |