2-{[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(3,5-dimethylpiperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(3,5-dimethylpiperidin-1-yl)ethan-1-one
2-{[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(3,5-dimethylpiperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | C292-0467 |
| Compound Name: | 2-{[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(3,5-dimethylpiperidin-1-yl)ethan-1-one |
| Molecular Weight: | 389.47 |
| Molecular Formula: | C19 H23 N3 O4 S |
| Smiles: | CC1CC(C)CN(C1)C(CSc1nnc(c2ccc3c(c2)OCCO3)o1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.2397 |
| logD: | 2.2397 |
| logSw: | -2.7316 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.147 |
| InChI Key: | PKJCQFGMWVMNQE-UHFFFAOYSA-N |