rel-(4R,5R)-10-oxo-2-(propane-2-sulfonyl)-N-{[4-(propan-2-yl)phenyl]methyl}-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
Chemical Structure Depiction of
rel-(4R,5R)-10-oxo-2-(propane-2-sulfonyl)-N-{[4-(propan-2-yl)phenyl]methyl}-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
rel-(4R,5R)-10-oxo-2-(propane-2-sulfonyl)-N-{[4-(propan-2-yl)phenyl]methyl}-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
Compound characteristics
| Compound ID: | SC77-0887 |
| Compound Name: | rel-(4R,5R)-10-oxo-2-(propane-2-sulfonyl)-N-{[4-(propan-2-yl)phenyl]methyl}-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide |
| Molecular Weight: | 437.56 |
| Molecular Formula: | C21 H31 N3 O5 S |
| Smiles: | CC(C)c1ccc(CNC([C@H]2CN(C[C@]23C(NCCO3)=O)S(C(C)C)(=O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.8564 |
| logD: | 1.8564 |
| logSw: | -2.6189 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.781 |
| InChI Key: | OTTPWKDXNNELBK-NQIIRXRSSA-N |