4-benzyl-3-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-benzyl-3-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
4-benzyl-3-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | K261-2822 |
| Compound Name: | 4-benzyl-3-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione |
| Molecular Weight: | 443.59 |
| Molecular Formula: | C22 H25 N3 O3 S2 |
| Smiles: | CC1CCN(CC1)C(CSC1=NS(c2ccccc2N1Cc1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8053 |
| logD: | 3.8053 |
| logSw: | -3.8521 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.106 |
| InChI Key: | CRKFAKPBMYBILY-UHFFFAOYSA-N |