rel-(4R,5R)-N-[(2,5-dimethylphenyl)methyl]-10-oxo-2-(propane-2-sulfonyl)-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
Chemical Structure Depiction of
rel-(4R,5R)-N-[(2,5-dimethylphenyl)methyl]-10-oxo-2-(propane-2-sulfonyl)-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
rel-(4R,5R)-N-[(2,5-dimethylphenyl)methyl]-10-oxo-2-(propane-2-sulfonyl)-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide
Compound characteristics
| Compound ID: | SC77-1403 |
| Compound Name: | rel-(4R,5R)-N-[(2,5-dimethylphenyl)methyl]-10-oxo-2-(propane-2-sulfonyl)-6-oxa-2,9-diazaspiro[4.5]decane-4-carboxamide |
| Molecular Weight: | 423.53 |
| Molecular Formula: | C20 H29 N3 O5 S |
| Smiles: | CC(C)S(N1C[C@H](C(NCc2cc(C)ccc2C)=O)[C@]2(C1)C(NCCO2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.8336 |
| logD: | 1.8336 |
| logSw: | -2.5989 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.781 |
| InChI Key: | OPNHGMIXOSLCDD-XLIONFOSSA-N |