ethyl 4-formyl-2,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-formyl-2,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrrole-3-carboxylate
ethyl 4-formyl-2,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | C799-0088 |
| Compound Name: | ethyl 4-formyl-2,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 299.37 |
| Molecular Formula: | C18 H21 N O3 |
| Smiles: | CCOC(c1c(C=O)c(C)n(Cc2ccc(C)cc2)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3217 |
| logD: | 3.3217 |
| logSw: | -3.3087 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.849 |
| InChI Key: | PBJPIDNCFAPQBL-UHFFFAOYSA-N |