6-(4-benzylpiperazine-1-sulfonyl)-3-methyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-(4-benzylpiperazine-1-sulfonyl)-3-methyl-1,3-benzothiazol-2(3H)-one
6-(4-benzylpiperazine-1-sulfonyl)-3-methyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | F818-0513 |
| Compound Name: | 6-(4-benzylpiperazine-1-sulfonyl)-3-methyl-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 403.52 |
| Molecular Formula: | C19 H21 N3 O3 S2 |
| Smiles: | CN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0771 |
| logD: | 3.0702 |
| logSw: | -3.515 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 51.1 |
| InChI Key: | YXPJTBGZAAFAPH-UHFFFAOYSA-N |