3-(2H-1,3-benzodioxol-5-yl)-2-cyano-N-(2-methylphenyl)prop-2-enamide
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-2-cyano-N-(2-methylphenyl)prop-2-enamide
3-(2H-1,3-benzodioxol-5-yl)-2-cyano-N-(2-methylphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 8009-0137 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-2-cyano-N-(2-methylphenyl)prop-2-enamide |
| Molecular Weight: | 306.32 |
| Molecular Formula: | C18 H14 N2 O3 |
| Smiles: | Cc1ccccc1NC(C(=C\c1ccc2c(c1)OCO2)\C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4378 |
| logD: | 3.4357 |
| logSw: | -3.5927 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.804 |
| InChI Key: | ZTLPXHNKYVHMAQ-UHFFFAOYSA-N |