rel-(4R,5R)-10-oxo-2-(propane-2-sulfonyl)-N-{[4-(trifluoromethyl)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-(trifluoromethyl)phenyl]methyl}-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
rel-(4R,5R)-10-oxo-2-(propane-2-sulfonyl)-N-{[4-(trifluoromethyl)phenyl]methyl}-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
Compound characteristics
| Compound ID: | SC77-0842 |
| Compound Name: | rel-(4R,5R)-10-oxo-2-(propane-2-sulfonyl)-N-{[4-(trifluoromethyl)phenyl]methyl}-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide |
| Molecular Weight: | 463.47 |
| Molecular Formula: | C19 H24 F3 N3 O5 S |
| Smiles: | CC(C)S(N1C[C@H](C(NCc2ccc(cc2)C(F)(F)F)=O)[C@]2(C1)C(NCCO2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.391 |
| logD: | 1.391 |
| logSw: | -2.428 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.781 |
| InChI Key: | SKTIHSHAIXQGNO-QAPCUYQASA-N |