1-ethyl-2-[2-(4-ethylanilino)-2-oxoethyl]-4-methyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-ethyl-2-[2-(4-ethylanilino)-2-oxoethyl]-4-methyl-1H-pyrrole-3-carboxylic acid
1-ethyl-2-[2-(4-ethylanilino)-2-oxoethyl]-4-methyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0340 |
| Compound Name: | 1-ethyl-2-[2-(4-ethylanilino)-2-oxoethyl]-4-methyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 314.38 |
| Molecular Formula: | C18 H22 N2 O3 |
| Smiles: | CCc1ccc(cc1)NC(Cc1c(C(O)=O)c(C)cn1CC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1486 |
| logD: | 1.3493 |
| logSw: | -3.0861 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.26 |
| InChI Key: | NYJPYPFVFGCPDT-UHFFFAOYSA-N |