N-[(2,3-dimethoxyphenyl)methyl]-2-{1,1,3-trioxo-2-[4-(propan-2-yl)phenyl]-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl}acetamide
Chemical Structure Depiction of
N-[(2,3-dimethoxyphenyl)methyl]-2-{1,1,3-trioxo-2-[4-(propan-2-yl)phenyl]-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl}acetamide
N-[(2,3-dimethoxyphenyl)methyl]-2-{1,1,3-trioxo-2-[4-(propan-2-yl)phenyl]-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl}acetamide
Compound characteristics
| Compound ID: | K261-3033 |
| Compound Name: | N-[(2,3-dimethoxyphenyl)methyl]-2-{1,1,3-trioxo-2-[4-(propan-2-yl)phenyl]-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl}acetamide |
| Molecular Weight: | 523.61 |
| Molecular Formula: | C27 H29 N3 O6 S |
| Smiles: | CC(C)c1ccc(cc1)N1C(N(CC(NCc2cccc(c2OC)OC)=O)c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7174 |
| logD: | 4.7174 |
| logSw: | -4.4035 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.562 |
| InChI Key: | NQJFRTPRLYOSBL-UHFFFAOYSA-N |