4-({[(2-ethoxyphenyl)methyl]amino}methyl)-2,5-dimethyl-1-[(3-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
4-({[(2-ethoxyphenyl)methyl]amino}methyl)-2,5-dimethyl-1-[(3-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid
4-({[(2-ethoxyphenyl)methyl]amino}methyl)-2,5-dimethyl-1-[(3-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | C879-1771 |
| Compound Name: | 4-({[(2-ethoxyphenyl)methyl]amino}methyl)-2,5-dimethyl-1-[(3-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 406.52 |
| Molecular Formula: | C25 H30 N2 O3 |
| Smiles: | CCOc1ccccc1CNCc1c(C(O)=O)c(C)n(Cc2cccc(C)c2)c1C |
| Stereo: | ACHIRAL |
| logP: | 4.8339 |
| logD: | 4.8339 |
| logSw: | -4.5055 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.32 |
| InChI Key: | MSMHNVGMFOXLKJ-UHFFFAOYSA-N |