2-[(4-benzyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-(3-chloro-4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-[(4-benzyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-(3-chloro-4-methoxyphenyl)acetamide
2-[(4-benzyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-(3-chloro-4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | K261-2831 |
| Compound Name: | 2-[(4-benzyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-(3-chloro-4-methoxyphenyl)acetamide |
| Molecular Weight: | 502.01 |
| Molecular Formula: | C23 H20 Cl N3 O4 S2 |
| Smiles: | COc1ccc(cc1[Cl])NC(CSC1=NS(c2ccccc2N1Cc1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7227 |
| logD: | 4.7225 |
| logSw: | -4.8597 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.493 |
| InChI Key: | QNOYNZCXEVKELR-UHFFFAOYSA-N |