N-(cyanomethyl)-3,5-dimethoxybenzamide
Chemical Structure Depiction of
N-(cyanomethyl)-3,5-dimethoxybenzamide
N-(cyanomethyl)-3,5-dimethoxybenzamide
Compound characteristics
| Compound ID: | Y030-2072 |
| Compound Name: | N-(cyanomethyl)-3,5-dimethoxybenzamide |
| Molecular Weight: | 220.22 |
| Molecular Formula: | C11 H12 N2 O3 |
| Smiles: | COc1cc(cc(c1)OC)C(NCC#N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2261 |
| logD: | 1.2261 |
| logSw: | -1.9088 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.344 |
| InChI Key: | XWIDYPRPZPVDHQ-UHFFFAOYSA-N |