3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-1-(thiophen-3-yl)prop-2-en-1-one
Chemical Structure Depiction of
3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-1-(thiophen-3-yl)prop-2-en-1-one
3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-1-(thiophen-3-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | 8019-9072 |
| Compound Name: | 3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-1-(thiophen-3-yl)prop-2-en-1-one |
| Molecular Weight: | 318.35 |
| Molecular Formula: | C16 H14 O5 S |
| Smiles: | COc1cc(/C=C/C(c2ccsc2)=O)c(c2c1OCO2)OC |
| Stereo: | ACHIRAL |
| logP: | 2.9968 |
| logD: | 2.9968 |
| logSw: | -3.202 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.064 |
| InChI Key: | YSJXEKGPUQUXJY-UHFFFAOYSA-N |