N-(2-cyano-4,5-diethoxyphenyl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-(2-cyano-4,5-diethoxyphenyl)-2H-1,3-benzodioxole-5-carboxamide
N-(2-cyano-4,5-diethoxyphenyl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | 8015-0022 |
| Compound Name: | N-(2-cyano-4,5-diethoxyphenyl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 354.36 |
| Molecular Formula: | C19 H18 N2 O5 |
| Smiles: | CCOc1cc(C#N)c(cc1OCC)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.527 |
| logD: | 2.4454 |
| logSw: | -3.1106 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.224 |
| InChI Key: | RUCKFNOOSAJCOS-UHFFFAOYSA-N |