methyl N-benzoyl-2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3,3,3-trifluoroalaninate
Chemical Structure Depiction of
methyl N-benzoyl-2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3,3,3-trifluoroalaninate
methyl N-benzoyl-2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3,3,3-trifluoroalaninate
Compound characteristics
| Compound ID: | 8007-1981 |
| Compound Name: | methyl N-benzoyl-2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3,3,3-trifluoroalaninate |
| Molecular Weight: | 440.42 |
| Molecular Formula: | C21 H23 F3 N2 O5 |
| Smiles: | COC(C(C(F)(F)F)(NCCc1ccc(c(c1)OC)OC)NC(c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7666 |
| logD: | 2.2222 |
| logSw: | -3.3108 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.125 |
| InChI Key: | CBPHJYOBWWRXAE-HXUWFJFHSA-N |