2-{[5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethan-1-one
Chemical Structure Depiction of
2-{[5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethan-1-one
2-{[5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethan-1-one
Compound characteristics
| Compound ID: | 7653-2970 |
| Compound Name: | 2-{[5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethan-1-one |
| Molecular Weight: | 423.27 |
| Molecular Formula: | C18 H12 Cl2 N2 O4 S |
| Smiles: | C1COc2cc(ccc2O1)C(CSc1nnc(c2ccc(cc2[Cl])[Cl])o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5416 |
| logD: | 3.5416 |
| logSw: | -4.2579 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.134 |
| InChI Key: | KMUSXPCHHBJYTM-UHFFFAOYSA-N |