2-[(1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-(3-methyl-1H-pyrazol-5-yl)acetamide
Chemical Structure Depiction of
2-[(1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-(3-methyl-1H-pyrazol-5-yl)acetamide
2-[(1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-(3-methyl-1H-pyrazol-5-yl)acetamide
Compound characteristics
| Compound ID: | K261-2111 |
| Compound Name: | 2-[(1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-(3-methyl-1H-pyrazol-5-yl)acetamide |
| Molecular Weight: | 351.4 |
| Molecular Formula: | C13 H13 N5 O3 S2 |
| Smiles: | Cc1cc(NC(CSC2Nc3ccccc3S(N=2)(=O)=O)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 0.5957 |
| logD: | 0.5393 |
| logSw: | -2.3954 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.99 |
| InChI Key: | SPQYRZVPTSSLNB-UHFFFAOYSA-N |