ethyl 3-[3-(2H-1,3-benzodioxol-5-yl)prop-2-enamido]-1H-indole-2-carboxylate
Chemical Structure Depiction of
ethyl 3-[3-(2H-1,3-benzodioxol-5-yl)prop-2-enamido]-1H-indole-2-carboxylate
ethyl 3-[3-(2H-1,3-benzodioxol-5-yl)prop-2-enamido]-1H-indole-2-carboxylate
Compound characteristics
| Compound ID: | C175-0062 |
| Compound Name: | ethyl 3-[3-(2H-1,3-benzodioxol-5-yl)prop-2-enamido]-1H-indole-2-carboxylate |
| Molecular Weight: | 378.38 |
| Molecular Formula: | C21 H18 N2 O5 |
| Smiles: | CCOC(c1c(c2ccccc2[nH]1)NC(/C=C/c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6978 |
| logD: | 3.6591 |
| logSw: | -4.2631 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.709 |
| InChI Key: | GGHPUMXBDYTGJS-UHFFFAOYSA-N |