3-{5-(4-methoxyphenyl)-1-[2-(2-methylanilino)-2-oxoethyl]-1H-pyrrol-2-yl}propanoic acid
Chemical Structure Depiction of
3-{5-(4-methoxyphenyl)-1-[2-(2-methylanilino)-2-oxoethyl]-1H-pyrrol-2-yl}propanoic acid
3-{5-(4-methoxyphenyl)-1-[2-(2-methylanilino)-2-oxoethyl]-1H-pyrrol-2-yl}propanoic acid
Compound characteristics
| Compound ID: | D135-0110 |
| Compound Name: | 3-{5-(4-methoxyphenyl)-1-[2-(2-methylanilino)-2-oxoethyl]-1H-pyrrol-2-yl}propanoic acid |
| Molecular Weight: | 392.45 |
| Molecular Formula: | C23 H24 N2 O4 |
| Smiles: | Cc1ccccc1NC(Cn1c(CCC(O)=O)ccc1c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8353 |
| logD: | 1.0214 |
| logSw: | -4.0059 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.031 |
| InChI Key: | XTUQPZVMYONMDQ-UHFFFAOYSA-N |