3-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1-(pyrrolidin-1-yl)prop-2-en-1-one
Chemical Structure Depiction of
3-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1-(pyrrolidin-1-yl)prop-2-en-1-one
3-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1-(pyrrolidin-1-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | 8019-6687 |
| Compound Name: | 3-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1-(pyrrolidin-1-yl)prop-2-en-1-one |
| Molecular Weight: | 275.3 |
| Molecular Formula: | C15 H17 N O4 |
| Smiles: | COc1cc(/C=C/C(N2CCCC2)=O)cc2c1OCO2 |
| Stereo: | ACHIRAL |
| logP: | 2.276 |
| logD: | 2.276 |
| logSw: | -2.4907 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.155 |
| InChI Key: | PPBMNVPPIVZDKM-UHFFFAOYSA-N |