N-(2-cyanocyclopent-1-en-1-yl)-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-(2-cyanocyclopent-1-en-1-yl)-3,4,5-trimethoxybenzamide
N-(2-cyanocyclopent-1-en-1-yl)-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | 8016-9050 |
| Compound Name: | N-(2-cyanocyclopent-1-en-1-yl)-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 302.33 |
| Molecular Formula: | C16 H18 N2 O4 |
| Smiles: | COc1cc(cc(c1OC)OC)C(NC1CCCC=1C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7378 |
| logD: | 1.7112 |
| logSw: | -2.4716 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.731 |
| InChI Key: | NFJATROCONZQDE-UHFFFAOYSA-N |