3-[1-(2,4-dimethoxyphenyl)-5-(4-methoxyphenyl)-1H-pyrrol-2-yl]propanoic acid
Chemical Structure Depiction of
3-[1-(2,4-dimethoxyphenyl)-5-(4-methoxyphenyl)-1H-pyrrol-2-yl]propanoic acid
3-[1-(2,4-dimethoxyphenyl)-5-(4-methoxyphenyl)-1H-pyrrol-2-yl]propanoic acid
Compound characteristics
| Compound ID: | 5408-2455 |
| Compound Name: | 3-[1-(2,4-dimethoxyphenyl)-5-(4-methoxyphenyl)-1H-pyrrol-2-yl]propanoic acid |
| Molecular Weight: | 381.43 |
| Molecular Formula: | C22 H23 N O5 |
| Smiles: | COc1ccc(cc1)c1ccc(CCC(O)=O)n1c1ccc(cc1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.2498 |
| logD: | 1.436 |
| logSw: | -4.2481 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.196 |
| InChI Key: | KRMBSCRMGGOOBX-UHFFFAOYSA-N |