4-butyl-3-[(2-oxo-2-phenylethyl)sulfanyl]-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-butyl-3-[(2-oxo-2-phenylethyl)sulfanyl]-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
4-butyl-3-[(2-oxo-2-phenylethyl)sulfanyl]-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | K261-2486 |
| Compound Name: | 4-butyl-3-[(2-oxo-2-phenylethyl)sulfanyl]-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione |
| Molecular Weight: | 388.51 |
| Molecular Formula: | C19 H20 N2 O3 S2 |
| Smiles: | CCCCN1C(=NS(c2ccccc12)(=O)=O)SCC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8958 |
| logD: | 3.8958 |
| logSw: | -3.8527 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.21 |
| InChI Key: | YMQDQZQPFHAPGG-UHFFFAOYSA-N |