3-(2H-1,3-benzodioxol-5-yl)-2-[4-(2-methylpropoxy)benzamido]prop-2-enoic acid
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-2-[4-(2-methylpropoxy)benzamido]prop-2-enoic acid
3-(2H-1,3-benzodioxol-5-yl)-2-[4-(2-methylpropoxy)benzamido]prop-2-enoic acid
Compound characteristics
| Compound ID: | 3633-0258 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-2-[4-(2-methylpropoxy)benzamido]prop-2-enoic acid |
| Molecular Weight: | 383.4 |
| Molecular Formula: | C21 H21 N O6 |
| Smiles: | CC(C)COc1ccc(cc1)C(NC(=C\c1ccc2c(c1)OCO2)\C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6683 |
| logD: | -0.4331 |
| logSw: | -3.8699 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.186 |
| InChI Key: | XILQAKHRDQLJSJ-UHFFFAOYSA-N |