3-[(3,4-dimethoxyphenyl)methyl]-7-(morpholine-4-sulfonyl)-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
3-[(3,4-dimethoxyphenyl)methyl]-7-(morpholine-4-sulfonyl)-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
3-[(3,4-dimethoxyphenyl)methyl]-7-(morpholine-4-sulfonyl)-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | E782-0773 |
| Compound Name: | 3-[(3,4-dimethoxyphenyl)methyl]-7-(morpholine-4-sulfonyl)-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione |
| Molecular Weight: | 481.55 |
| Molecular Formula: | C20 H23 N3 O7 S2 |
| Smiles: | COc1ccc(CC2NS(c3cc(ccc3N=2)S(N2CCOCC2)(=O)=O)(=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.3718 |
| logD: | 0.7708 |
| logSw: | -2.5457 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.505 |
| InChI Key: | VLXVUCHKUWUPPM-UHFFFAOYSA-N |