2-[2-(3-fluoroanilino)-2-oxoethyl]-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2-[2-(3-fluoroanilino)-2-oxoethyl]-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
2-[2-(3-fluoroanilino)-2-oxoethyl]-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0259 |
| Compound Name: | 2-[2-(3-fluoroanilino)-2-oxoethyl]-1,4-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 290.29 |
| Molecular Formula: | C15 H15 F N2 O3 |
| Smiles: | Cc1cn(C)c(CC(Nc2cccc(c2)F)=O)c1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0576 |
| logD: | 0.2584 |
| logSw: | -2.5015 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.091 |
| InChI Key: | BOTRVWNDOHWUEO-UHFFFAOYSA-N |