N-{2-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]-5,5-dimethyl-3-oxocyclohex-1-en-1-yl}alanine
Chemical Structure Depiction of
N-{2-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]-5,5-dimethyl-3-oxocyclohex-1-en-1-yl}alanine
N-{2-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]-5,5-dimethyl-3-oxocyclohex-1-en-1-yl}alanine
Compound characteristics
| Compound ID: | 8015-6463 |
| Compound Name: | N-{2-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]-5,5-dimethyl-3-oxocyclohex-1-en-1-yl}alanine |
| Molecular Weight: | 426.47 |
| Molecular Formula: | C23 H26 N2 O6 |
| Smiles: | CC(C(O)=O)NC1CC(C)(C)CC(C=1C(CCCN1C(c2ccccc2C1=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0493 |
| logD: | -2.0893 |
| logSw: | -2.0854 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.043 |
| InChI Key: | ABZMWNNRUYYZII-ZDUSSCGKSA-N |