2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-oxopentanenitrile
Chemical Structure Depiction of
2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-oxopentanenitrile
2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-oxopentanenitrile
Compound characteristics
| Compound ID: | 3126-1449 |
| Compound Name: | 2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-oxopentanenitrile |
| Molecular Weight: | 358.35 |
| Molecular Formula: | C20 H14 N4 O3 |
| Smiles: | CC(C(C(C#N)=C1Nc2ccccc2N1)=O)N1C(c2ccccc2C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7387 |
| logD: | 2.7364 |
| logSw: | -3.5744 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.945 |
| InChI Key: | XKGLLASWZOPLIJ-NSHDSACASA-N |