2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-(4-methoxyphenyl)-3-oxopropanenitrile
Chemical Structure Depiction of
2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-(4-methoxyphenyl)-3-oxopropanenitrile
2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-(4-methoxyphenyl)-3-oxopropanenitrile
Compound characteristics
| Compound ID: | 3126-1419 |
| Compound Name: | 2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-3-(4-methoxyphenyl)-3-oxopropanenitrile |
| Molecular Weight: | 291.31 |
| Molecular Formula: | C17 H13 N3 O2 |
| Smiles: | COc1ccc(cc1)C(C(C#N)=C1Nc2ccccc2N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0515 |
| logD: | 3.0514 |
| logSw: | -3.5535 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.623 |
| InChI Key: | ZZJADABBUYITJL-UHFFFAOYSA-N |