2-(4-bromophenyl)-5-{[2-(1,3-dioxan-2-yl)ethyl]sulfanyl}-1,3,4-oxadiazole
Chemical Structure Depiction of
2-(4-bromophenyl)-5-{[2-(1,3-dioxan-2-yl)ethyl]sulfanyl}-1,3,4-oxadiazole
2-(4-bromophenyl)-5-{[2-(1,3-dioxan-2-yl)ethyl]sulfanyl}-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | 4333-1418 |
| Compound Name: | 2-(4-bromophenyl)-5-{[2-(1,3-dioxan-2-yl)ethyl]sulfanyl}-1,3,4-oxadiazole |
| Molecular Weight: | 371.25 |
| Molecular Formula: | C14 H15 Br N2 O3 S |
| Smiles: | C1COC(CCSc2nnc(c3ccc(cc3)[Br])o2)OC1 |
| Stereo: | ACHIRAL |
| logP: | 2.5566 |
| logD: | 2.5566 |
| logSw: | -2.5043 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.236 |
| InChI Key: | PTIHDWLEGSKOHX-UHFFFAOYSA-N |