N-(2-cyanocyclopent-1-en-1-yl)-3,4,5-triethoxybenzamide
Chemical Structure Depiction of
N-(2-cyanocyclopent-1-en-1-yl)-3,4,5-triethoxybenzamide
N-(2-cyanocyclopent-1-en-1-yl)-3,4,5-triethoxybenzamide
Compound characteristics
| Compound ID: | 8018-3446 |
| Compound Name: | N-(2-cyanocyclopent-1-en-1-yl)-3,4,5-triethoxybenzamide |
| Molecular Weight: | 344.41 |
| Molecular Formula: | C19 H24 N2 O4 |
| Smiles: | CCOc1cc(cc(c1OCC)OCC)C(NC1CCCC=1C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6966 |
| logD: | 2.67 |
| logSw: | -2.9901 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.47 |
| InChI Key: | ISBFSDRVKSBHHP-UHFFFAOYSA-N |