2-{2-[(2-ethylphenyl)(methyl)amino]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2-{2-[(2-ethylphenyl)(methyl)amino]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
2-{2-[(2-ethylphenyl)(methyl)amino]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0081 |
| Compound Name: | 2-{2-[(2-ethylphenyl)(methyl)amino]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 314.38 |
| Molecular Formula: | C18 H22 N2 O3 |
| Smiles: | CCc1ccccc1N(C)C(Cc1c(C(O)=O)c(C)cn1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6633 |
| logD: | 0.8641 |
| logSw: | -2.6039 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.754 |
| InChI Key: | ZXLYGQFGKOHCAG-UHFFFAOYSA-N |