3-[1-butyl-5-(4-methoxyphenyl)-1H-pyrrol-2-yl]propanoic acid
Chemical Structure Depiction of
3-[1-butyl-5-(4-methoxyphenyl)-1H-pyrrol-2-yl]propanoic acid
3-[1-butyl-5-(4-methoxyphenyl)-1H-pyrrol-2-yl]propanoic acid
Compound characteristics
| Compound ID: | 6060-0084 |
| Compound Name: | 3-[1-butyl-5-(4-methoxyphenyl)-1H-pyrrol-2-yl]propanoic acid |
| Molecular Weight: | 301.38 |
| Molecular Formula: | C18 H23 N O3 |
| Smiles: | CCCCn1c(CCC(O)=O)ccc1c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.1647 |
| logD: | 1.3509 |
| logSw: | -3.9198 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.83 |
| InChI Key: | RMEZDRSODGDHDM-UHFFFAOYSA-N |