7-{5-[2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}-10-cyclopentyldibenzo[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-cyclopentyldibenzo[b,f][1,4]thiazepin-11(10H)-one
7-{5-[2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}-10-cyclopentyldibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | G946-0642 |
| Compound Name: | 7-{5-[2-(2-chlorophenyl)ethenyl]-1,2,4-oxadiazol-3-yl}-10-cyclopentyldibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 500.02 |
| Molecular Formula: | C28 H22 Cl N3 O2 S |
| Smiles: | C1CCC(C1)N1C(c2ccccc2Sc2cc(ccc12)c1nc(/C=C/c2ccccc2[Cl])on1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.9828 |
| logD: | 7.9828 |
| logSw: | -6.5386 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.06 |
| InChI Key: | JHOOIXUDBRBLCG-UHFFFAOYSA-N |