methyl 3-(2H-1,3-benzodioxol-5-yl)-2-(4-butoxybenzamido)prop-2-enoate
Chemical Structure Depiction of
methyl 3-(2H-1,3-benzodioxol-5-yl)-2-(4-butoxybenzamido)prop-2-enoate
methyl 3-(2H-1,3-benzodioxol-5-yl)-2-(4-butoxybenzamido)prop-2-enoate
Compound characteristics
| Compound ID: | 5902-0943 |
| Compound Name: | methyl 3-(2H-1,3-benzodioxol-5-yl)-2-(4-butoxybenzamido)prop-2-enoate |
| Molecular Weight: | 397.43 |
| Molecular Formula: | C22 H23 N O6 |
| Smiles: | CCCCOc1ccc(cc1)C(NC(=C/c1ccc2c(c1)OCO2)\C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6401 |
| logD: | 4.5195 |
| logSw: | -4.4677 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.87 |
| InChI Key: | PDYNPADLNRTUNN-UHFFFAOYSA-N |