2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl 4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)butanoate
Chemical Structure Depiction of
2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl 4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)butanoate
2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl 4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)butanoate
Compound characteristics
| Compound ID: | K261-1444 |
| Compound Name: | 2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl 4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)butanoate |
| Molecular Weight: | 441.5 |
| Molecular Formula: | C22 H23 N3 O5 S |
| Smiles: | C(CC1NS(c2ccccc2N=1)(=O)=O)CC(=O)OCC(N1CCCc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.897 |
| logD: | 1.5711 |
| logSw: | -2.5355 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.215 |
| InChI Key: | UNTRSZKWFNPUSF-UHFFFAOYSA-N |