ethyl 4-(2H-1,3-benzodioxol-5-yl)-3-(3,5-dimethoxybenzamido)-1-methyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-(2H-1,3-benzodioxol-5-yl)-3-(3,5-dimethoxybenzamido)-1-methyl-1H-pyrrole-2-carboxylate
ethyl 4-(2H-1,3-benzodioxol-5-yl)-3-(3,5-dimethoxybenzamido)-1-methyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V012-5604 |
| Compound Name: | ethyl 4-(2H-1,3-benzodioxol-5-yl)-3-(3,5-dimethoxybenzamido)-1-methyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 452.46 |
| Molecular Formula: | C24 H24 N2 O7 |
| Smiles: | CCOC(c1c(c(cn1C)c1ccc2c(c1)OCO2)NC(c1cc(cc(c1)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5544 |
| logD: | 3.4584 |
| logSw: | -3.5928 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.705 |
| InChI Key: | YMFIVWRLXZRTDE-UHFFFAOYSA-N |