N-methyl-4-oxo-8-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide
Chemical Structure Depiction of
N-methyl-4-oxo-8-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide
N-methyl-4-oxo-8-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide
Compound characteristics
Compound ID: | S747-0230 |
Compound Name: | N-methyl-4-oxo-8-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide |
Molecular Weight: | 337.42 |
Molecular Formula: | C16 H27 N5 O3 |
Smiles: | CC(C)c1nc(C2CCCN(CCC(NCC2)=O)C(NC)=O)on1 |
Stereo: | RACEMIC MIXTURE |
logP: | 0.7336 |
logD: | 0.7336 |
logSw: | -1.2995 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 84.483 |
InChI Key: | PKQLFAADNXJISS-LBPRGKRZSA-N |