2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-4-(3-methoxyphenoxy)-3-oxobutanenitrile
Chemical Structure Depiction of
2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-4-(3-methoxyphenoxy)-3-oxobutanenitrile
2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-4-(3-methoxyphenoxy)-3-oxobutanenitrile
Compound characteristics
| Compound ID: | 2727-5017 |
| Compound Name: | 2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-4-(3-methoxyphenoxy)-3-oxobutanenitrile |
| Molecular Weight: | 321.33 |
| Molecular Formula: | C18 H15 N3 O3 |
| Smiles: | COc1cccc(c1)OCC(C(C#N)=C1Nc2ccccc2N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9674 |
| logD: | 2.966 |
| logSw: | -3.366 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.631 |
| InChI Key: | ZQDGDABDAUSPFK-UHFFFAOYSA-N |