1-[4-(6-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(4-methylbenzene-1-sulfonyl)ethan-1-one
Chemical Structure Depiction of
1-[4-(6-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(4-methylbenzene-1-sulfonyl)ethan-1-one
1-[4-(6-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(4-methylbenzene-1-sulfonyl)ethan-1-one
Compound characteristics
| Compound ID: | G856-8986 |
| Compound Name: | 1-[4-(6-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(4-methylbenzene-1-sulfonyl)ethan-1-one |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C21 H23 N3 O4 S2 |
| Smiles: | Cc1ccc(cc1)S(CC(N1CCN(CC1)c1nc2ccc(cc2s1)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4172 |
| logD: | 3.417 |
| logSw: | -3.7741 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.735 |
| InChI Key: | IVWUBDOSOXXLCE-UHFFFAOYSA-N |