methyl 5-(3,4-dimethoxyphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxylate
Chemical Structure Depiction of
methyl 5-(3,4-dimethoxyphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxylate
methyl 5-(3,4-dimethoxyphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxylate
Compound characteristics
| Compound ID: | D717-0212 |
| Compound Name: | methyl 5-(3,4-dimethoxyphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxylate |
| Molecular Weight: | 326.33 |
| Molecular Formula: | C13 H14 N2 O6 S |
| Smiles: | COC(C1=CC(c2ccc(c(c2)OC)OC)=NS(N1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3242 |
| logD: | -3.7391 |
| logSw: | -2.4029 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.896 |
| InChI Key: | IVUPDDGVTIAPHA-UHFFFAOYSA-N |