3-{4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxobutyl}-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
3-{4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxobutyl}-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
3-{4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxobutyl}-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | F275-0044 |
| Compound Name: | 3-{4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxobutyl}-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione |
| Molecular Weight: | 430.5 |
| Molecular Formula: | C21 H23 F N4 O3 S |
| Smiles: | C(CC1NS(c2ccccc2N=1)(=O)=O)CC(N1CCN(CC1)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6624 |
| logD: | 1.3365 |
| logSw: | -2.5362 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.277 |
| InChI Key: | YKCCDMULOHFHRF-UHFFFAOYSA-N |