3-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-1-(pyrrolidin-1-yl)prop-2-en-1-one
Chemical Structure Depiction of
3-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-1-(pyrrolidin-1-yl)prop-2-en-1-one
3-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-1-(pyrrolidin-1-yl)prop-2-en-1-one
Compound characteristics
Compound ID: | 8019-6688 |
Compound Name: | 3-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-1-(pyrrolidin-1-yl)prop-2-en-1-one |
Molecular Weight: | 305.33 |
Molecular Formula: | C16 H19 N O5 |
Smiles: | COc1c(/C=C/C(N2CCCC2)=O)cc2c(c1OC)OCO2 |
Stereo: | ACHIRAL |
logP: | 2.2561 |
logD: | 2.2561 |
logSw: | -2.6129 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 48.959 |
InChI Key: | KEZQPEQTIXBYKJ-UHFFFAOYSA-N |