7-{5-[(4-chlorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-10-cyclopentyldibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
7-{5-[(4-chlorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-10-cyclopentyldibenzo[b,f][1,4]thiazepin-11(10H)-one
7-{5-[(4-chlorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-10-cyclopentyldibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | G946-0690 |
| Compound Name: | 7-{5-[(4-chlorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-10-cyclopentyldibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 504.01 |
| Molecular Formula: | C27 H22 Cl N3 O3 S |
| Smiles: | C1CCC(C1)N1C(c2ccccc2Sc2cc(ccc12)c1nc(COc2ccc(cc2)[Cl])on1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1024 |
| logD: | 7.1024 |
| logSw: | -6.4906 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.559 |
| InChI Key: | ZVEHTPDYDCWTFO-UHFFFAOYSA-N |