1-ethyl-2-{2-[ethyl(phenyl)amino]-2-oxoethyl}-4-methyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-ethyl-2-{2-[ethyl(phenyl)amino]-2-oxoethyl}-4-methyl-1H-pyrrole-3-carboxylic acid
1-ethyl-2-{2-[ethyl(phenyl)amino]-2-oxoethyl}-4-methyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0383 |
| Compound Name: | 1-ethyl-2-{2-[ethyl(phenyl)amino]-2-oxoethyl}-4-methyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 314.38 |
| Molecular Formula: | C18 H22 N2 O3 |
| Smiles: | CCN(C(Cc1c(C(O)=O)c(C)cn1CC)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8202 |
| logD: | 1.021 |
| logSw: | -2.807 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.202 |
| InChI Key: | ISZMTFVVQXKXEN-UHFFFAOYSA-N |