1-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-3-(4-methylbenzene-1-sulfonyl)propan-1-one
Chemical Structure Depiction of
1-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-3-(4-methylbenzene-1-sulfonyl)propan-1-one
1-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-3-(4-methylbenzene-1-sulfonyl)propan-1-one
Compound characteristics
| Compound ID: | G856-7259 |
| Compound Name: | 1-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-3-(4-methylbenzene-1-sulfonyl)propan-1-one |
| Molecular Weight: | 429.56 |
| Molecular Formula: | C21 H23 N3 O3 S2 |
| Smiles: | Cc1ccc(cc1)S(CCC(N1CCN(CC1)c1nc2ccccc2s1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3891 |
| logD: | 3.389 |
| logSw: | -3.6682 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.191 |
| InChI Key: | XNJSQFSBFVIUMH-UHFFFAOYSA-N |