2-[2-(3-ethylanilino)-2-oxoethyl]-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2-[2-(3-ethylanilino)-2-oxoethyl]-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
2-[2-(3-ethylanilino)-2-oxoethyl]-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0131 |
| Compound Name: | 2-[2-(3-ethylanilino)-2-oxoethyl]-1,4-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 300.36 |
| Molecular Formula: | C17 H20 N2 O3 |
| Smiles: | CCc1cccc(c1)NC(Cc1c(C(O)=O)c(C)cn1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6947 |
| logD: | 0.8955 |
| logSw: | -2.563 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.091 |
| InChI Key: | QZURCBFCTXCSLY-UHFFFAOYSA-N |