3-{5-(4-chlorophenyl)-1-[4-(ethoxycarbonyl)-3-hydroxyphenyl]-1H-pyrrol-2-yl}propanoic acid
Chemical Structure Depiction of
3-{5-(4-chlorophenyl)-1-[4-(ethoxycarbonyl)-3-hydroxyphenyl]-1H-pyrrol-2-yl}propanoic acid
3-{5-(4-chlorophenyl)-1-[4-(ethoxycarbonyl)-3-hydroxyphenyl]-1H-pyrrol-2-yl}propanoic acid
Compound characteristics
| Compound ID: | 6238-0020 |
| Compound Name: | 3-{5-(4-chlorophenyl)-1-[4-(ethoxycarbonyl)-3-hydroxyphenyl]-1H-pyrrol-2-yl}propanoic acid |
| Molecular Weight: | 413.86 |
| Molecular Formula: | C22 H20 Cl N O5 |
| Smiles: | CCOC(c1ccc(cc1O)n1c(CCC(O)=O)ccc1c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7438 |
| logD: | 2.93 |
| logSw: | -5.6254 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.081 |
| InChI Key: | WYINEJSMCAIBRH-UHFFFAOYSA-N |