2-{[5-(2,3-dihydro-1,4-benzodioxin-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{[5-(2,3-dihydro-1,4-benzodioxin-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one
2-{[5-(2,3-dihydro-1,4-benzodioxin-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | C292-0476 |
| Compound Name: | 2-{[5-(2,3-dihydro-1,4-benzodioxin-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one |
| Molecular Weight: | 438.5 |
| Molecular Formula: | C22 H22 N4 O4 S |
| Smiles: | C1CN(CCN1C(CSc1nnc(C2COc3ccccc3O2)o1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9153 |
| logD: | 2.9153 |
| logSw: | -3.2512 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.154 |
| InChI Key: | LKAJQOQLXRQYEW-IBGZPJMESA-N |