7-{5-[2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}-10-propyldibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
7-{5-[2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}-10-propyldibenzo[b,f][1,4]thiazepin-11(10H)-one
7-{5-[2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}-10-propyldibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | G946-0342 |
| Compound Name: | 7-{5-[2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}-10-propyldibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 473.98 |
| Molecular Formula: | C26 H20 Cl N3 O2 S |
| Smiles: | CCCN1C(c2ccccc2Sc2cc(ccc12)c1nc(/C=C/c2ccccc2[Cl])on1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.9076 |
| logD: | 7.9076 |
| logSw: | -6.2881 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.722 |
| InChI Key: | ZSMNDXAFIOOPTD-UHFFFAOYSA-N |