4-(2,5-dimethyl-1H-pyrrol-1-yl)benzene-1,2-dicarboxylic acid
Chemical Structure Depiction of
4-(2,5-dimethyl-1H-pyrrol-1-yl)benzene-1,2-dicarboxylic acid
4-(2,5-dimethyl-1H-pyrrol-1-yl)benzene-1,2-dicarboxylic acid
Compound characteristics
| Compound ID: | 2817-4394 |
| Compound Name: | 4-(2,5-dimethyl-1H-pyrrol-1-yl)benzene-1,2-dicarboxylic acid |
| Molecular Weight: | 259.26 |
| Molecular Formula: | C14 H13 N O4 |
| Smiles: | Cc1ccc(C)n1c1ccc(C(O)=O)c(c1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2235 |
| logD: | -3.2859 |
| logSw: | -2.446 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.944 |
| InChI Key: | UQFYRZIMRBEYDD-UHFFFAOYSA-N |