rel-(4R,5R)-N-{3-[ethyl(phenyl)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-[ethyl(phenyl)amino]propyl}-10-oxo-2-(propane-2-sulfonyl)-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
rel-(4R,5R)-N-{3-[ethyl(phenyl)amino]propyl}-10-oxo-2-(propane-2-sulfonyl)-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
Compound characteristics
| Compound ID: | SC77-0897 |
| Compound Name: | rel-(4R,5R)-N-{3-[ethyl(phenyl)amino]propyl}-10-oxo-2-(propane-2-sulfonyl)-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide |
| Molecular Weight: | 466.6 |
| Molecular Formula: | C22 H34 N4 O5 S |
| Smiles: | CCN(CCCNC([C@H]1CN(C[C@]12C(NCCO2)=O)S(C(C)C)(=O)=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4645 |
| logD: | 1.4353 |
| logSw: | -2.4205 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.612 |
| InChI Key: | NXDSBQYUORSZMQ-KNQAVFIVSA-N |