N-{1-(2H-1,3-benzodioxol-5-yl)-3-[(2-hydroxyethyl)amino]-3-oxoprop-1-en-2-yl}-4-methoxybenzamide
Chemical Structure Depiction of
N-{1-(2H-1,3-benzodioxol-5-yl)-3-[(2-hydroxyethyl)amino]-3-oxoprop-1-en-2-yl}-4-methoxybenzamide
N-{1-(2H-1,3-benzodioxol-5-yl)-3-[(2-hydroxyethyl)amino]-3-oxoprop-1-en-2-yl}-4-methoxybenzamide
Compound characteristics
| Compound ID: | 3802-0382 |
| Compound Name: | N-{1-(2H-1,3-benzodioxol-5-yl)-3-[(2-hydroxyethyl)amino]-3-oxoprop-1-en-2-yl}-4-methoxybenzamide |
| Molecular Weight: | 384.39 |
| Molecular Formula: | C20 H20 N2 O6 |
| Smiles: | COc1ccc(cc1)C(NC(=C/c1ccc2c(c1)OCO2)\C(NCCO)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6147 |
| logD: | 1.0724 |
| logSw: | -2.0895 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.004 |
| InChI Key: | DOBBSFIYIITVGA-UHFFFAOYSA-N |