1-ethyl-2-[2-(3-methoxyanilino)-2-oxoethyl]-4-methyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-ethyl-2-[2-(3-methoxyanilino)-2-oxoethyl]-4-methyl-1H-pyrrole-3-carboxylic acid
1-ethyl-2-[2-(3-methoxyanilino)-2-oxoethyl]-4-methyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
Compound ID: | G955-0289 |
Compound Name: | 1-ethyl-2-[2-(3-methoxyanilino)-2-oxoethyl]-4-methyl-1H-pyrrole-3-carboxylic acid |
Molecular Weight: | 316.35 |
Molecular Formula: | C17 H20 N2 O4 |
Smiles: | CCn1cc(C)c(C(O)=O)c1CC(Nc1cccc(c1)OC)=O |
Stereo: | ACHIRAL |
logP: | 2.2843 |
logD: | 0.4851 |
logSw: | -2.6611 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 60.804 |
InChI Key: | MEROLDMGFSKJEH-UHFFFAOYSA-N |