2,5-dimethyl-1-[(3-methylphenyl)methyl]-4-[(propylamino)methyl]-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2,5-dimethyl-1-[(3-methylphenyl)methyl]-4-[(propylamino)methyl]-1H-pyrrole-3-carboxylic acid
2,5-dimethyl-1-[(3-methylphenyl)methyl]-4-[(propylamino)methyl]-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G396-0117 |
| Compound Name: | 2,5-dimethyl-1-[(3-methylphenyl)methyl]-4-[(propylamino)methyl]-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 314.43 |
| Molecular Formula: | C19 H26 N2 O2 |
| Smiles: | CCCNCc1c(C(O)=O)c(C)n(Cc2cccc(C)c2)c1C |
| Stereo: | ACHIRAL |
| logP: | 3.7137 |
| logD: | 3.7137 |
| logSw: | -4.1186 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.223 |
| InChI Key: | WHHQSLGDXJQLEA-UHFFFAOYSA-N |