N-{4-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]-5-oxo-1,2,5,6-tetrahydro[1,1'-biphenyl]-3-yl}alanine
Chemical Structure Depiction of
N-{4-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]-5-oxo-1,2,5,6-tetrahydro[1,1'-biphenyl]-3-yl}alanine
N-{4-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]-5-oxo-1,2,5,6-tetrahydro[1,1'-biphenyl]-3-yl}alanine
Compound characteristics
| Compound ID: | 8016-1990 |
| Compound Name: | N-{4-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]-5-oxo-1,2,5,6-tetrahydro[1,1'-biphenyl]-3-yl}alanine |
| Molecular Weight: | 474.51 |
| Molecular Formula: | C27 H26 N2 O6 |
| Smiles: | CC(C(O)=O)NC1CC(CC(C=1C(CCCN1C(c2ccccc2C1=O)=O)=O)=O)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3699 |
| logD: | -0.7687 |
| logSw: | -2.9923 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.771 |
| InChI Key: | XQTBBQGCZVDYHQ-UHFFFAOYSA-N |