methyl 2-[3-(2H-1,3-benzodioxol-5-yl)prop-2-enamido]benzoate
Chemical Structure Depiction of
methyl 2-[3-(2H-1,3-benzodioxol-5-yl)prop-2-enamido]benzoate
methyl 2-[3-(2H-1,3-benzodioxol-5-yl)prop-2-enamido]benzoate
Compound characteristics
Compound ID: | 4100-1558 |
Compound Name: | methyl 2-[3-(2H-1,3-benzodioxol-5-yl)prop-2-enamido]benzoate |
Molecular Weight: | 325.32 |
Molecular Formula: | C18 H15 N O5 |
Smiles: | COC(c1ccccc1NC(/C=C/c1ccc2c(c1)OCO2)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7254 |
logD: | 3.7071 |
logSw: | -4.08 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.708 |
InChI Key: | SERYIYNGCWBJFA-UHFFFAOYSA-N |