3-{1-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-5-(4-methoxyphenyl)-1H-pyrrol-2-yl}propanoic acid
Chemical Structure Depiction of
3-{1-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-5-(4-methoxyphenyl)-1H-pyrrol-2-yl}propanoic acid
3-{1-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-5-(4-methoxyphenyl)-1H-pyrrol-2-yl}propanoic acid
Compound characteristics
| Compound ID: | D135-0134 |
| Compound Name: | 3-{1-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-5-(4-methoxyphenyl)-1H-pyrrol-2-yl}propanoic acid |
| Molecular Weight: | 426.9 |
| Molecular Formula: | C23 H23 Cl N2 O4 |
| Smiles: | Cc1ccc(cc1[Cl])NC(Cn1c(CCC(O)=O)ccc1c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4306 |
| logD: | 2.6168 |
| logSw: | -5.6331 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.729 |
| InChI Key: | RZBKGEARSRUNBE-UHFFFAOYSA-N |