3-{5-(4-chlorophenyl)-1-[2-(2-methoxyanilino)-2-oxoethyl]-1H-pyrrol-2-yl}propanoic acid
Chemical Structure Depiction of
3-{5-(4-chlorophenyl)-1-[2-(2-methoxyanilino)-2-oxoethyl]-1H-pyrrol-2-yl}propanoic acid
3-{5-(4-chlorophenyl)-1-[2-(2-methoxyanilino)-2-oxoethyl]-1H-pyrrol-2-yl}propanoic acid
Compound characteristics
| Compound ID: | D135-0116 |
| Compound Name: | 3-{5-(4-chlorophenyl)-1-[2-(2-methoxyanilino)-2-oxoethyl]-1H-pyrrol-2-yl}propanoic acid |
| Molecular Weight: | 412.87 |
| Molecular Formula: | C22 H21 Cl N2 O4 |
| Smiles: | COc1ccccc1NC(Cn1c(CCC(O)=O)ccc1c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4059 |
| logD: | 1.592 |
| logSw: | -4.5169 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.118 |
| InChI Key: | HLQAYIUBTZYABD-UHFFFAOYSA-N |