N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(thiophen-2-yl)prop-2-enamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(thiophen-2-yl)prop-2-enamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(thiophen-2-yl)prop-2-enamide
Compound characteristics
Compound ID: | Y500-1107 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(thiophen-2-yl)prop-2-enamide |
Molecular Weight: | 287.33 |
Molecular Formula: | C15 H13 N O3 S |
Smiles: | C(c1ccc2c(c1)OCO2)NC(/C=C/c1cccs1)=O |
Stereo: | ACHIRAL |
logP: | 2.7725 |
logD: | 2.7725 |
logSw: | -3.126 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.572 |
InChI Key: | LZOINNHUGIGQHL-UHFFFAOYSA-N |