tert-butyl rel-(9aR,12aS)-9-oxododecahydrocyclopenta[b][1,5]diazacycloundecine-1(2H)-carboxylate
Chemical Structure Depiction of
tert-butyl rel-(9aR,12aS)-9-oxododecahydrocyclopenta[b][1,5]diazacycloundecine-1(2H)-carboxylate
tert-butyl rel-(9aR,12aS)-9-oxododecahydrocyclopenta[b][1,5]diazacycloundecine-1(2H)-carboxylate
Compound characteristics
| Compound ID: | S746-0019 |
| Compound Name: | tert-butyl rel-(9aR,12aS)-9-oxododecahydrocyclopenta[b][1,5]diazacycloundecine-1(2H)-carboxylate |
| Molecular Weight: | 310.44 |
| Molecular Formula: | C17 H30 N2 O3 |
| Smiles: | CC(C)(C)OC(N1CCCCCCNC([C@@H]2CCC[C@H]12)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.7565 |
| logD: | 2.7565 |
| logSw: | -3.0988 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.307 |
| InChI Key: | CCCHVEIMTYNQCC-KGLIPLIRSA-N |