2,5-dimethyl-1-[(4-methylphenyl)methyl]-4-({[(3,4,5-triethoxyphenyl)methyl]amino}methyl)-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2,5-dimethyl-1-[(4-methylphenyl)methyl]-4-({[(3,4,5-triethoxyphenyl)methyl]amino}methyl)-1H-pyrrole-3-carboxylic acid
2,5-dimethyl-1-[(4-methylphenyl)methyl]-4-({[(3,4,5-triethoxyphenyl)methyl]amino}methyl)-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | C879-1801 |
| Compound Name: | 2,5-dimethyl-1-[(4-methylphenyl)methyl]-4-({[(3,4,5-triethoxyphenyl)methyl]amino}methyl)-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 494.63 |
| Molecular Formula: | C29 H38 N2 O5 |
| Smiles: | CCOc1cc(CNCc2c(C(O)=O)c(C)n(Cc3ccc(C)cc3)c2C)cc(c1OCC)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.7764 |
| logD: | 4.7764 |
| logSw: | -4.4356 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.827 |
| InChI Key: | CEIDVWIKNFNEHX-UHFFFAOYSA-N |