1-[(2E)-3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)prop-2-enoyl]proline
Chemical Structure Depiction of
1-[(2E)-3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)prop-2-enoyl]proline
1-[(2E)-3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)prop-2-enoyl]proline
Compound characteristics
| Compound ID: | 8019-8465 |
| Compound Name: | 1-[(2E)-3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)prop-2-enoyl]proline |
| Molecular Weight: | 349.34 |
| Molecular Formula: | C17 H19 N O7 |
| Smiles: | COc1cc(/C=C/C(N2CCCC2C(O)=O)=O)c(c2c1OCO2)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.4181 |
| logD: | -3.0329 |
| logSw: | -1.0835 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.659 |
| InChI Key: | HFHDDBIDYBKLKK-NSHDSACASA-N |