6-[3-(2H-1,3-benzodioxol-5-yl)-2-(4-methoxybenzamido)prop-2-enamido]hexanoic acid
Chemical Structure Depiction of
6-[3-(2H-1,3-benzodioxol-5-yl)-2-(4-methoxybenzamido)prop-2-enamido]hexanoic acid
6-[3-(2H-1,3-benzodioxol-5-yl)-2-(4-methoxybenzamido)prop-2-enamido]hexanoic acid
Compound characteristics
| Compound ID: | 3802-0404 |
| Compound Name: | 6-[3-(2H-1,3-benzodioxol-5-yl)-2-(4-methoxybenzamido)prop-2-enamido]hexanoic acid |
| Molecular Weight: | 454.48 |
| Molecular Formula: | C24 H26 N2 O7 |
| Smiles: | COc1ccc(cc1)C(NC(=C/c1ccc2c(c1)OCO2)\C(NCCCCCC(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3734 |
| logD: | -0.4548 |
| logSw: | -2.8517 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.732 |
| InChI Key: | WPEUQXGNCCKUOX-UHFFFAOYSA-N |