3-[5-(4-bromophenyl)-1-(3,5-dimethylphenyl)-1H-pyrrol-2-yl]propanoic acid
Chemical Structure Depiction of
3-[5-(4-bromophenyl)-1-(3,5-dimethylphenyl)-1H-pyrrol-2-yl]propanoic acid
3-[5-(4-bromophenyl)-1-(3,5-dimethylphenyl)-1H-pyrrol-2-yl]propanoic acid
Compound characteristics
| Compound ID: | 5408-2364 |
| Compound Name: | 3-[5-(4-bromophenyl)-1-(3,5-dimethylphenyl)-1H-pyrrol-2-yl]propanoic acid |
| Molecular Weight: | 398.3 |
| Molecular Formula: | C21 H20 Br N O2 |
| Smiles: | Cc1cc(C)cc(c1)n1c(CCC(O)=O)ccc1c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.0615 |
| logD: | 3.2477 |
| logSw: | -5.259 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.7793 |
| InChI Key: | YPEGTUXTWKBJDH-UHFFFAOYSA-N |