7-[5-(5-bromopyridin-3-yl)-1,2,4-oxadiazol-3-yl]-10-ethyldibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
7-[5-(5-bromopyridin-3-yl)-1,2,4-oxadiazol-3-yl]-10-ethyldibenzo[b,f][1,4]thiazepin-11(10H)-one
7-[5-(5-bromopyridin-3-yl)-1,2,4-oxadiazol-3-yl]-10-ethyldibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | G946-0257 |
| Compound Name: | 7-[5-(5-bromopyridin-3-yl)-1,2,4-oxadiazol-3-yl]-10-ethyldibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 479.35 |
| Molecular Formula: | C22 H15 Br N4 O2 S |
| Smiles: | CCN1C(c2ccccc2Sc2cc(ccc12)c1nc(c2cc(cnc2)[Br])on1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8988 |
| logD: | 5.8988 |
| logSw: | -5.345 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.41 |
| InChI Key: | OIHCGVZJOZPNRY-UHFFFAOYSA-N |