methyl 1-ethyl-3,5-dimethyl-4-[(3-methylphenoxy)acetyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1-ethyl-3,5-dimethyl-4-[(3-methylphenoxy)acetyl]-1H-pyrrole-2-carboxylate
methyl 1-ethyl-3,5-dimethyl-4-[(3-methylphenoxy)acetyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V016-8834 |
| Compound Name: | methyl 1-ethyl-3,5-dimethyl-4-[(3-methylphenoxy)acetyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 329.39 |
| Molecular Formula: | C19 H23 N O4 |
| Smiles: | CCn1c(C)c(C(COc2cccc(C)c2)=O)c(C)c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.7455 |
| logD: | 3.7455 |
| logSw: | -4.2641 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.61 |
| InChI Key: | DUOAVFFUSZHLLL-UHFFFAOYSA-N |