2-(2-{[(4-ethoxyphenyl)methyl]amino}-2-oxoethyl)-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2-(2-{[(4-ethoxyphenyl)methyl]amino}-2-oxoethyl)-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
2-(2-{[(4-ethoxyphenyl)methyl]amino}-2-oxoethyl)-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | C066-5630 |
| Compound Name: | 2-(2-{[(4-ethoxyphenyl)methyl]amino}-2-oxoethyl)-1,4-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 330.38 |
| Molecular Formula: | C18 H22 N2 O4 |
| Smiles: | CCOc1ccc(CNC(Cc2c(C(O)=O)c(C)cn2C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.9356 |
| logD: | 0.1364 |
| logSw: | -2.3158 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.537 |
| InChI Key: | PGWJUIJCTSYNRN-UHFFFAOYSA-N |