3-[1-(carboxymethyl)-5-(4-methylphenyl)-1H-pyrrol-2-yl]propanoic acid
Chemical Structure Depiction of
3-[1-(carboxymethyl)-5-(4-methylphenyl)-1H-pyrrol-2-yl]propanoic acid
3-[1-(carboxymethyl)-5-(4-methylphenyl)-1H-pyrrol-2-yl]propanoic acid
Compound characteristics
| Compound ID: | 8013-6093 |
| Compound Name: | 3-[1-(carboxymethyl)-5-(4-methylphenyl)-1H-pyrrol-2-yl]propanoic acid |
| Molecular Weight: | 287.31 |
| Molecular Formula: | C16 H17 N O4 |
| Smiles: | Cc1ccc(cc1)c1ccc(CCC(O)=O)n1CC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7856 |
| logD: | -2.6179 |
| logSw: | -2.0537 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.691 |
| InChI Key: | PCXIOEHMINECRC-UHFFFAOYSA-N |