2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-oxobutanenitrile
Chemical Structure Depiction of
2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-oxobutanenitrile
2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-oxobutanenitrile
Compound characteristics
| Compound ID: | 8019-4696 |
| Compound Name: | 2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-oxobutanenitrile |
| Molecular Weight: | 199.21 |
| Molecular Formula: | C11 H9 N3 O |
| Smiles: | CC(C(C#N)=C1Nc2ccccc2N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3878 |
| logD: | 1.3871 |
| logSw: | -1.8976 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.439 |
| InChI Key: | HILDGRNBKLPHNJ-UHFFFAOYSA-N |