3-[1-butyl-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid
Chemical Structure Depiction of
3-[1-butyl-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid
3-[1-butyl-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid
Compound characteristics
| Compound ID: | 6060-0081 |
| Compound Name: | 3-[1-butyl-5-(4-fluorophenyl)-1H-pyrrol-2-yl]propanoic acid |
| Molecular Weight: | 289.35 |
| Molecular Formula: | C17 H20 F N O2 |
| Smiles: | CCCCn1c(CCC(O)=O)ccc1c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 4.2114 |
| logD: | 1.3976 |
| logSw: | -3.9542 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.286 |
| InChI Key: | NTNOEDPRBRTSJO-UHFFFAOYSA-N |