rel-(2R,3S)-N-(2,2-difluoroethyl)-4-[(2,4-dimethoxyphenyl)methyl]-5-oxo-3-phenylmorpholine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,3S)-N-(2,2-difluoroethyl)-4-[(2,4-dimethoxyphenyl)methyl]-5-oxo-3-phenylmorpholine-2-carboxamide
rel-(2R,3S)-N-(2,2-difluoroethyl)-4-[(2,4-dimethoxyphenyl)methyl]-5-oxo-3-phenylmorpholine-2-carboxamide
Compound characteristics
| Compound ID: | S681-0716 |
| Compound Name: | rel-(2R,3S)-N-(2,2-difluoroethyl)-4-[(2,4-dimethoxyphenyl)methyl]-5-oxo-3-phenylmorpholine-2-carboxamide |
| Molecular Weight: | 434.44 |
| Molecular Formula: | C22 H24 F2 N2 O5 |
| Smiles: | COc1ccc(CN2C(CO[C@@H](C(NCC(F)F)=O)[C@@H]2c2ccccc2)=O)c(c1)OC |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.1519 |
| logD: | 2.1517 |
| logSw: | -2.8327 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.027 |
| InChI Key: | HVWGDFFYMUTUKK-RTWAWAEBSA-N |