2-methylpropyl 4-[1,1-dioxo-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate
Chemical Structure Depiction of
2-methylpropyl 4-[1,1-dioxo-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate
2-methylpropyl 4-[1,1-dioxo-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate
Compound characteristics
| Compound ID: | F475-0240 |
| Compound Name: | 2-methylpropyl 4-[1,1-dioxo-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]benzoate |
| Molecular Weight: | 428.43 |
| Molecular Formula: | C19 H19 F3 N2 O4 S |
| Smiles: | CC(C)COC(c1ccc(cc1)C1Nc2cc(ccc2S(N1)(=O)=O)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2456 |
| logD: | 4.2454 |
| logSw: | -4.3041 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.23 |
| InChI Key: | XIQZEQIBBATAQM-KRWDZBQOSA-N |