2-{2-[ethyl(phenyl)amino]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2-{2-[ethyl(phenyl)amino]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
2-{2-[ethyl(phenyl)amino]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0117 |
| Compound Name: | 2-{2-[ethyl(phenyl)amino]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 300.36 |
| Molecular Formula: | C17 H20 N2 O3 |
| Smiles: | CCN(C(Cc1c(C(O)=O)c(C)cn1C)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5066 |
| logD: | 0.7074 |
| logSw: | -2.134 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.033 |
| InChI Key: | PMKZBGFBCWEYDM-UHFFFAOYSA-N |