4-(4-chlorophenoxy)-2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-oxobutanenitrile
Chemical Structure Depiction of
4-(4-chlorophenoxy)-2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-oxobutanenitrile
4-(4-chlorophenoxy)-2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-oxobutanenitrile
Compound characteristics
| Compound ID: | 3126-1431 |
| Compound Name: | 4-(4-chlorophenoxy)-2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-oxobutanenitrile |
| Molecular Weight: | 325.75 |
| Molecular Formula: | C17 H12 Cl N3 O2 |
| Smiles: | C(C(C(C#N)=C1Nc2ccccc2N1)=O)Oc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.5145 |
| logD: | 3.5132 |
| logSw: | -3.9484 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.087 |
| InChI Key: | NOLAORBYWPIOPT-UHFFFAOYSA-N |