4-oxo-N-phenyl-8-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide
Chemical Structure Depiction of
4-oxo-N-phenyl-8-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide
4-oxo-N-phenyl-8-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide
Compound characteristics
Compound ID: | S747-0212 |
Compound Name: | 4-oxo-N-phenyl-8-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecane-1-carboxamide |
Molecular Weight: | 399.49 |
Molecular Formula: | C21 H29 N5 O3 |
Smiles: | CC(C)c1nc(C2CCCN(CCC(NCC2)=O)C(Nc2ccccc2)=O)on1 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.1546 |
logD: | 2.1546 |
logSw: | -2.6922 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 82.739 |
InChI Key: | UFYJKGPVNMLSOY-INIZCTEOSA-N |