3-[2-(2-carboxyethyl)-5-(4-chlorophenyl)-1H-pyrrol-1-yl]benzoic acid
Chemical Structure Depiction of
3-[2-(2-carboxyethyl)-5-(4-chlorophenyl)-1H-pyrrol-1-yl]benzoic acid
3-[2-(2-carboxyethyl)-5-(4-chlorophenyl)-1H-pyrrol-1-yl]benzoic acid
Compound characteristics
| Compound ID: | 6060-0163 |
| Compound Name: | 3-[2-(2-carboxyethyl)-5-(4-chlorophenyl)-1H-pyrrol-1-yl]benzoic acid |
| Molecular Weight: | 369.8 |
| Molecular Formula: | C20 H16 Cl N O4 |
| Smiles: | C(Cc1ccc(c2ccc(cc2)[Cl])n1c1cccc(c1)C(O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7662 |
| logD: | 0.1342 |
| logSw: | -4.7141 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.188 |
| InChI Key: | XZVAOSAVKPUMQO-UHFFFAOYSA-N |