3-{1-[4-(ethoxycarbonyl)phenyl]-5-(4-methylphenyl)-1H-pyrrol-2-yl}propanoic acid
Chemical Structure Depiction of
3-{1-[4-(ethoxycarbonyl)phenyl]-5-(4-methylphenyl)-1H-pyrrol-2-yl}propanoic acid
3-{1-[4-(ethoxycarbonyl)phenyl]-5-(4-methylphenyl)-1H-pyrrol-2-yl}propanoic acid
Compound characteristics
| Compound ID: | 5408-2418 |
| Compound Name: | 3-{1-[4-(ethoxycarbonyl)phenyl]-5-(4-methylphenyl)-1H-pyrrol-2-yl}propanoic acid |
| Molecular Weight: | 377.44 |
| Molecular Formula: | C23 H23 N O4 |
| Smiles: | CCOC(c1ccc(cc1)n1c(CCC(O)=O)ccc1c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2897 |
| logD: | 2.4759 |
| logSw: | -5.1339 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.533 |
| InChI Key: | AHXMKQIYGJKAHU-UHFFFAOYSA-N |