4-[(benzylamino)methyl]-2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
4-[(benzylamino)methyl]-2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrole-3-carboxylic acid
4-[(benzylamino)methyl]-2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G396-2228 |
| Compound Name: | 4-[(benzylamino)methyl]-2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 348.44 |
| Molecular Formula: | C22 H24 N2 O2 |
| Smiles: | Cc1ccc(cc1)n1c(C)c(CNCc2ccccc2)c(C(O)=O)c1C |
| Stereo: | ACHIRAL |
| logP: | 3.8766 |
| logD: | 3.8766 |
| logSw: | -4.2564 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.853 |
| InChI Key: | JFOXEXGFYVNXKA-UHFFFAOYSA-N |