rel-(9aR,12aS)-decahydro-2H-cyclopenta[f][1,4,8]oxadiazacycloundecin-9(6H)-one
Chemical Structure Depiction of
rel-(9aR,12aS)-decahydro-2H-cyclopenta[f][1,4,8]oxadiazacycloundecin-9(6H)-one
rel-(9aR,12aS)-decahydro-2H-cyclopenta[f][1,4,8]oxadiazacycloundecin-9(6H)-one
Compound characteristics
| Compound ID: | S795-0078 |
| Compound Name: | rel-(9aR,12aS)-decahydro-2H-cyclopenta[f][1,4,8]oxadiazacycloundecin-9(6H)-one |
| Molecular Weight: | 212.29 |
| Molecular Formula: | C11 H20 N2 O2 |
| Smiles: | C1C[C@H]2[C@@H](C1)C(NCCOCCCN2)=O |
| Stereo: | RELATIVE |
| logP: | -0.4167 |
| logD: | -3.1298 |
| logSw: | -1.0048 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.205 |
| InChI Key: | WCRSLTQEHLOTRZ-ZJUUUORDSA-N |