3-(1-butyl-5-phenyl-1H-pyrrol-2-yl)propanoic acid
Chemical Structure Depiction of
3-(1-butyl-5-phenyl-1H-pyrrol-2-yl)propanoic acid
3-(1-butyl-5-phenyl-1H-pyrrol-2-yl)propanoic acid
Compound characteristics
| Compound ID: | 6060-0031 |
| Compound Name: | 3-(1-butyl-5-phenyl-1H-pyrrol-2-yl)propanoic acid |
| Molecular Weight: | 271.36 |
| Molecular Formula: | C17 H21 N O2 |
| Smiles: | CCCCn1c(CCC(O)=O)ccc1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0773 |
| logD: | 1.2635 |
| logSw: | -3.8195 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.286 |
| InChI Key: | XEKJFLXFMXVBGK-UHFFFAOYSA-N |