N-(2-{2-[4-(2H-1,3-benzodioxol-5-yl)but-3-en-2-ylidene]hydrazinyl}-2-oxoethyl)-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-(2-{2-[4-(2H-1,3-benzodioxol-5-yl)but-3-en-2-ylidene]hydrazinyl}-2-oxoethyl)-3,4,5-trimethoxybenzamide
N-(2-{2-[4-(2H-1,3-benzodioxol-5-yl)but-3-en-2-ylidene]hydrazinyl}-2-oxoethyl)-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | 8006-9305 |
| Compound Name: | N-(2-{2-[4-(2H-1,3-benzodioxol-5-yl)but-3-en-2-ylidene]hydrazinyl}-2-oxoethyl)-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 455.47 |
| Molecular Formula: | C23 H25 N3 O7 |
| Smiles: | C\C(/C=C/c1ccc2c(c1)OCO2)=N/NC(CNC(c1cc(c(c(c1)OC)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2184 |
| logD: | 3.2181 |
| logSw: | -3.3986 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.488 |
| InChI Key: | RJBONOZDMIECIM-UHFFFAOYSA-N |