2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrole-3-carboxylic acid
2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | 6223-0045 |
| Compound Name: | 2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 229.28 |
| Molecular Formula: | C14 H15 N O2 |
| Smiles: | Cc1ccc(cc1)n1c(C)cc(C(O)=O)c1C |
| Stereo: | ACHIRAL |
| logP: | 3.1318 |
| logD: | 0.1036 |
| logSw: | -3.0373 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.3114 |
| InChI Key: | YNFCEUIZSXIFCE-UHFFFAOYSA-N |