rel-(2R,3S)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-methyl-5-oxo-3-phenylmorpholine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,3S)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-methyl-5-oxo-3-phenylmorpholine-2-carboxamide
rel-(2R,3S)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-methyl-5-oxo-3-phenylmorpholine-2-carboxamide
Compound characteristics
| Compound ID: | S681-0322 |
| Compound Name: | rel-(2R,3S)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-methyl-5-oxo-3-phenylmorpholine-2-carboxamide |
| Molecular Weight: | 370.45 |
| Molecular Formula: | C20 H26 N4 O3 |
| Smiles: | CCn1c(C)c(CNC([C@H]2[C@H](c3ccccc3)N(C)C(CO2)=O)=O)c(C)n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.497 |
| logD: | 0.497 |
| logSw: | -1.6971 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.897 |
| InChI Key: | KXJMRTZOGHOSJJ-RTBURBONSA-N |