3-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
3-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
3-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | E883-0021 |
| Compound Name: | 3-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione |
| Molecular Weight: | 412.51 |
| Molecular Formula: | C21 H24 N4 O3 S |
| Smiles: | C(CC(N1CCN(CC1)Cc1ccccc1)=O)C1NS(c2ccccc2N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9536 |
| logD: | 0.9536 |
| logSw: | -2.2785 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.557 |
| InChI Key: | IDSKDSDWEPBWGN-UHFFFAOYSA-N |