7-[5-(4-bromophenyl)-1,2,4-oxadiazol-3-yl]-10-cyclopentyldibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
7-[5-(4-bromophenyl)-1,2,4-oxadiazol-3-yl]-10-cyclopentyldibenzo[b,f][1,4]thiazepin-11(10H)-one
7-[5-(4-bromophenyl)-1,2,4-oxadiazol-3-yl]-10-cyclopentyldibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | G946-0674 |
| Compound Name: | 7-[5-(4-bromophenyl)-1,2,4-oxadiazol-3-yl]-10-cyclopentyldibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 518.43 |
| Molecular Formula: | C26 H20 Br N3 O2 S |
| Smiles: | C1CCC(C1)N1C(c2ccccc2Sc2cc(ccc12)c1nc(c2ccc(cc2)[Br])on1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.5459 |
| logD: | 7.5459 |
| logSw: | -6.1431 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.394 |
| InChI Key: | WMHNIIIAOOHAEC-UHFFFAOYSA-N |