3-{1-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-5-(4-methoxyphenyl)-1H-pyrrol-2-yl}propanoic acid
Chemical Structure Depiction of
3-{1-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-5-(4-methoxyphenyl)-1H-pyrrol-2-yl}propanoic acid
3-{1-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-5-(4-methoxyphenyl)-1H-pyrrol-2-yl}propanoic acid
Compound characteristics
| Compound ID: | D135-0120 |
| Compound Name: | 3-{1-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-5-(4-methoxyphenyl)-1H-pyrrol-2-yl}propanoic acid |
| Molecular Weight: | 438.48 |
| Molecular Formula: | C24 H26 N2 O6 |
| Smiles: | COc1ccc(cc1)c1ccc(CCC(O)=O)n1CC(Nc1cc(ccc1OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7238 |
| logD: | 0.91 |
| logSw: | -4.0893 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.205 |
| InChI Key: | VEZIYFVCIVPSQT-UHFFFAOYSA-N |