3-[5-(4-chlorophenyl)-1-(propan-2-yl)-1H-pyrrol-2-yl]propanoic acid
Chemical Structure Depiction of
3-[5-(4-chlorophenyl)-1-(propan-2-yl)-1H-pyrrol-2-yl]propanoic acid
3-[5-(4-chlorophenyl)-1-(propan-2-yl)-1H-pyrrol-2-yl]propanoic acid
Compound characteristics
| Compound ID: | 6060-0112 |
| Compound Name: | 3-[5-(4-chlorophenyl)-1-(propan-2-yl)-1H-pyrrol-2-yl]propanoic acid |
| Molecular Weight: | 291.78 |
| Molecular Formula: | C16 H18 Cl N O2 |
| Smiles: | CC(C)n1c(CCC(O)=O)ccc1c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.1637 |
| logD: | 1.3499 |
| logSw: | -4.3255 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.383 |
| InChI Key: | XFNKORXOFHSNNJ-UHFFFAOYSA-N |