N-{1-(2H-1,3-benzodioxol-5-yl)-3-oxo-3-[(prop-2-en-1-yl)amino]prop-1-en-2-yl}-4-methoxybenzamide
Chemical Structure Depiction of
N-{1-(2H-1,3-benzodioxol-5-yl)-3-oxo-3-[(prop-2-en-1-yl)amino]prop-1-en-2-yl}-4-methoxybenzamide
N-{1-(2H-1,3-benzodioxol-5-yl)-3-oxo-3-[(prop-2-en-1-yl)amino]prop-1-en-2-yl}-4-methoxybenzamide
Compound characteristics
| Compound ID: | 3802-0384 |
| Compound Name: | N-{1-(2H-1,3-benzodioxol-5-yl)-3-oxo-3-[(prop-2-en-1-yl)amino]prop-1-en-2-yl}-4-methoxybenzamide |
| Molecular Weight: | 380.4 |
| Molecular Formula: | C21 H20 N2 O5 |
| Smiles: | COc1ccc(cc1)C(NC(=C/c1ccc2c(c1)OCO2)\C(NCC=C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6569 |
| logD: | 2.0934 |
| logSw: | -3.1767 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.349 |
| InChI Key: | YDVFDQOCBDPSPV-UHFFFAOYSA-N |