7-[5-(5-bromofuran-2-yl)-1,2,4-oxadiazol-3-yl]-10-methyldibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
7-[5-(5-bromofuran-2-yl)-1,2,4-oxadiazol-3-yl]-10-methyldibenzo[b,f][1,4]thiazepin-11(10H)-one
7-[5-(5-bromofuran-2-yl)-1,2,4-oxadiazol-3-yl]-10-methyldibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | G946-0040 |
| Compound Name: | 7-[5-(5-bromofuran-2-yl)-1,2,4-oxadiazol-3-yl]-10-methyldibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 454.3 |
| Molecular Formula: | C20 H12 Br N3 O3 S |
| Smiles: | CN1C(c2ccccc2Sc2cc(ccc12)c1nc(c2ccc(o2)[Br])on1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1276 |
| logD: | 5.1276 |
| logSw: | -5.0161 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.77 |
| InChI Key: | WIKTVDAJOSVXGJ-UHFFFAOYSA-N |