methyl N-[rel-(2R)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylethanoyl]phenylalaninate
Chemical Structure Depiction of
methyl N-[rel-(2R)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylethanoyl]phenylalaninate
methyl N-[rel-(2R)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylethanoyl]phenylalaninate
Compound characteristics
| Compound ID: | Y041-5218 |
| Compound Name: | methyl N-[rel-(2R)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylethanoyl]phenylalaninate |
| Molecular Weight: | 428.49 |
| Molecular Formula: | C26 H24 N2 O4 |
| Smiles: | COC([C@H](Cc1ccccc1)NC([C@H](c1ccccc1)N1Cc2ccccc2C1=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5029 |
| logD: | 3.5028 |
| logSw: | -3.6266 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.229 |
| InChI Key: | ZFICSVLOYBUBPD-DHIUTWEWSA-N |