N-(cyanomethyl)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamide
Chemical Structure Depiction of
N-(cyanomethyl)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamide
N-(cyanomethyl)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamide
Compound characteristics
| Compound ID: | Y031-6802 |
| Compound Name: | N-(cyanomethyl)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamide |
| Molecular Weight: | 243.22 |
| Molecular Formula: | C12 H9 N3 O3 |
| Smiles: | C(C#N)NC(CN1C(c2ccccc2C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1381 |
| logD: | 0.1381 |
| logSw: | -2.2631 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.568 |
| InChI Key: | CSDPPPRBIRPQDW-UHFFFAOYSA-N |