methyl N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidine-3-carbonyl]phenylalaninate
Chemical Structure Depiction of
methyl N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidine-3-carbonyl]phenylalaninate
methyl N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidine-3-carbonyl]phenylalaninate
Compound characteristics
| Compound ID: | Y043-0041 |
| Compound Name: | methyl N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidine-3-carbonyl]phenylalaninate |
| Molecular Weight: | 424.45 |
| Molecular Formula: | C23 H24 N2 O6 |
| Smiles: | COC([C@H](Cc1ccccc1)NC(C1CC(N(C1)c1ccc2c(c1)OCCO2)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.8733 |
| logD: | 0.8732 |
| logSw: | -1.798 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.029 |
| InChI Key: | NHAXFMKELZHTTB-DAFXYXGESA-N |