(2-chloro-4-fluorophenyl)methyl 4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzoate
Chemical Structure Depiction of
(2-chloro-4-fluorophenyl)methyl 4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzoate
(2-chloro-4-fluorophenyl)methyl 4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzoate
Compound characteristics
| Compound ID: | F475-0194 |
| Compound Name: | (2-chloro-4-fluorophenyl)methyl 4-(1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl)benzoate |
| Molecular Weight: | 446.88 |
| Molecular Formula: | C21 H16 Cl F N2 O4 S |
| Smiles: | C(c1ccc(cc1[Cl])F)OC(c1ccc(cc1)C1Nc2ccccc2S(N1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2508 |
| logD: | 4.2506 |
| logSw: | -4.4874 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.958 |
| InChI Key: | MHBOSVYTNBOLHC-FQEVSTJZSA-N |