rel-(4R,5R)-N-{3-[benzyl(ethyl)amino]propyl}-10-oxo-2-(propane-2-sulfonyl)-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
Chemical Structure Depiction of
rel-(4R,5R)-N-{3-[benzyl(ethyl)amino]propyl}-10-oxo-2-(propane-2-sulfonyl)-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
rel-(4R,5R)-N-{3-[benzyl(ethyl)amino]propyl}-10-oxo-2-(propane-2-sulfonyl)-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
Compound characteristics
Compound ID: | SC77-0898 |
Compound Name: | rel-(4R,5R)-N-{3-[benzyl(ethyl)amino]propyl}-10-oxo-2-(propane-2-sulfonyl)-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide |
Molecular Weight: | 480.63 |
Molecular Formula: | C23 H36 N4 O5 S |
Smiles: | CCN(CCCNC([C@H]1CN(C[C@]12C(NCCO2)=O)S(C(C)C)(=O)=O)=O)Cc1ccccc1 |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 1.1062 |
logD: | -0.5407 |
logSw: | -2.3258 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 93.309 |
InChI Key: | UDBRKKQTZXMNGD-OFNKIYASSA-N |