rel-(9aR,12aS)-N-ethyl-9-oxododecahydrocyclopenta[b][1,5]diazacycloundecine-1(2H)-carboxamide
Chemical Structure Depiction of
rel-(9aR,12aS)-N-ethyl-9-oxododecahydrocyclopenta[b][1,5]diazacycloundecine-1(2H)-carboxamide
rel-(9aR,12aS)-N-ethyl-9-oxododecahydrocyclopenta[b][1,5]diazacycloundecine-1(2H)-carboxamide
Compound characteristics
| Compound ID: | S732-0212 |
| Compound Name: | rel-(9aR,12aS)-N-ethyl-9-oxododecahydrocyclopenta[b][1,5]diazacycloundecine-1(2H)-carboxamide |
| Molecular Weight: | 281.4 |
| Molecular Formula: | C15 H27 N3 O2 |
| Smiles: | CCNC(N1CCCCCCNC([C@@H]2CCC[C@H]12)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3104 |
| logD: | 1.3104 |
| logSw: | -1.9989 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.914 |
| InChI Key: | OTDIUTAIZMZBNZ-OLZOCXBDSA-N |