1-(4-phenylpiperazin-1-yl)-2-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(4-phenylpiperazin-1-yl)-2-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]ethan-1-one
1-(4-phenylpiperazin-1-yl)-2-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | 6531-0007 |
| Compound Name: | 1-(4-phenylpiperazin-1-yl)-2-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C20 H19 N5 O S2 |
| Smiles: | C1CN(CCN1C(CSc1nnc2n1c1ccccc1s2)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3292 |
| logD: | 3.3291 |
| logSw: | -3.4288 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.959 |
| InChI Key: | ZHJJHKDTMXXVSY-UHFFFAOYSA-N |