3-{1-[4-(ethoxycarbonyl)phenyl]-5-phenyl-1H-pyrrol-2-yl}propanoic acid
Chemical Structure Depiction of
3-{1-[4-(ethoxycarbonyl)phenyl]-5-phenyl-1H-pyrrol-2-yl}propanoic acid
3-{1-[4-(ethoxycarbonyl)phenyl]-5-phenyl-1H-pyrrol-2-yl}propanoic acid
Compound characteristics
| Compound ID: | 5483-0007 |
| Compound Name: | 3-{1-[4-(ethoxycarbonyl)phenyl]-5-phenyl-1H-pyrrol-2-yl}propanoic acid |
| Molecular Weight: | 363.41 |
| Molecular Formula: | C22 H21 N O4 |
| Smiles: | CCOC(c1ccc(cc1)n1c(CCC(O)=O)ccc1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7613 |
| logD: | 1.9474 |
| logSw: | -4.3787 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.533 |
| InChI Key: | XDYDHJYULJWBKP-UHFFFAOYSA-N |