rel-(9aR,12aS)-1-(3-methoxypropanoyl)decahydro-2H-cyclopenta[f][1,4,8]oxadiazacycloundecin-9(6H)-one
Chemical Structure Depiction of
rel-(9aR,12aS)-1-(3-methoxypropanoyl)decahydro-2H-cyclopenta[f][1,4,8]oxadiazacycloundecin-9(6H)-one
rel-(9aR,12aS)-1-(3-methoxypropanoyl)decahydro-2H-cyclopenta[f][1,4,8]oxadiazacycloundecin-9(6H)-one
Compound characteristics
| Compound ID: | S795-0040 |
| Compound Name: | rel-(9aR,12aS)-1-(3-methoxypropanoyl)decahydro-2H-cyclopenta[f][1,4,8]oxadiazacycloundecin-9(6H)-one |
| Molecular Weight: | 298.38 |
| Molecular Formula: | C15 H26 N2 O4 |
| Smiles: | COCCC(N1CCCOCCNC([C@@H]2CCC[C@H]12)=O)=O |
| Stereo: | RELATIVE |
| logP: | -0.3991 |
| logD: | -0.3991 |
| logSw: | -1.2952 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.869 |
| InChI Key: | DJCHTBIZZYICTG-OLZOCXBDSA-N |