1,4-dimethyl-2-{2-[methyl(phenyl)amino]-2-oxoethyl}-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1,4-dimethyl-2-{2-[methyl(phenyl)amino]-2-oxoethyl}-1H-pyrrole-3-carboxylic acid
1,4-dimethyl-2-{2-[methyl(phenyl)amino]-2-oxoethyl}-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0119 |
| Compound Name: | 1,4-dimethyl-2-{2-[methyl(phenyl)amino]-2-oxoethyl}-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 286.33 |
| Molecular Formula: | C16 H18 N2 O3 |
| Smiles: | Cc1cn(C)c(CC(N(C)c2ccccc2)=O)c1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4034 |
| logD: | -0.3958 |
| logSw: | -1.5641 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.055 |
| InChI Key: | AJVVYQGWZINFEQ-UHFFFAOYSA-N |