3-[5-(4-bromophenyl)-1-(2-methylpropyl)-1H-pyrrol-2-yl]propanoic acid
Chemical Structure Depiction of
3-[5-(4-bromophenyl)-1-(2-methylpropyl)-1H-pyrrol-2-yl]propanoic acid
3-[5-(4-bromophenyl)-1-(2-methylpropyl)-1H-pyrrol-2-yl]propanoic acid
Compound characteristics
| Compound ID: | 6060-0121 |
| Compound Name: | 3-[5-(4-bromophenyl)-1-(2-methylpropyl)-1H-pyrrol-2-yl]propanoic acid |
| Molecular Weight: | 350.25 |
| Molecular Formula: | C17 H20 Br N O2 |
| Smiles: | CC(C)Cn1c(CCC(O)=O)ccc1c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.0335 |
| logD: | 2.2197 |
| logSw: | -4.5133 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.3076 |
| InChI Key: | BNEFDHHEPLXRHJ-UHFFFAOYSA-N |