2-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid
2-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0432 |
| Compound Name: | 2-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 358.39 |
| Molecular Formula: | C19 H22 N2 O5 |
| Smiles: | CCn1cc(C)c(C(O)=O)c1CC(Nc1ccc(cc1)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8193 |
| logD: | 1.0201 |
| logSw: | -3.0046 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.014 |
| InChI Key: | OCGNWEBKLMUNSI-UHFFFAOYSA-N |