7-[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]-10-(propan-2-yl)dibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
7-[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]-10-(propan-2-yl)dibenzo[b,f][1,4]thiazepin-11(10H)-one
7-[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]-10-(propan-2-yl)dibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | G946-0870 |
| Compound Name: | 7-[5-(furan-3-yl)-1,2,4-oxadiazol-3-yl]-10-(propan-2-yl)dibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 403.46 |
| Molecular Formula: | C22 H17 N3 O3 S |
| Smiles: | CC(C)N1C(c2ccccc2Sc2cc(ccc12)c1nc(c2ccoc2)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5232 |
| logD: | 5.5232 |
| logSw: | -5.468 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.602 |
| InChI Key: | IDZCIYMPOMRASD-UHFFFAOYSA-N |