2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-4,4-dimethyl-3-oxopentanenitrile
Chemical Structure Depiction of
2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-4,4-dimethyl-3-oxopentanenitrile
2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-4,4-dimethyl-3-oxopentanenitrile
Compound characteristics
| Compound ID: | 5848-2637 |
| Compound Name: | 2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-4,4-dimethyl-3-oxopentanenitrile |
| Molecular Weight: | 241.29 |
| Molecular Formula: | C14 H15 N3 O |
| Smiles: | CC(C)(C)C(C(C#N)=C1Nc2ccccc2N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8609 |
| logD: | 2.8603 |
| logSw: | -3.3732 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.351 |
| InChI Key: | DSUCFHILNUWEEL-UHFFFAOYSA-N |