4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid
Chemical Structure Depiction of
4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid
4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid
Compound characteristics
| Compound ID: | 2825-0087 |
| Compound Name: | 4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid |
| Molecular Weight: | 215.25 |
| Molecular Formula: | C13 H13 N O2 |
| Smiles: | Cc1ccc(C)n1c1ccc(cc1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8661 |
| logD: | -0.0201 |
| logSw: | -2.9874 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.5354 |
| InChI Key: | WNZAIUIEXCYTCY-UHFFFAOYSA-N |