methyl 4-[(3,4-dimethylphenoxy)acetyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[(3,4-dimethylphenoxy)acetyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-[(3,4-dimethylphenoxy)acetyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V019-5030 |
| Compound Name: | methyl 4-[(3,4-dimethylphenoxy)acetyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 343.42 |
| Molecular Formula: | C20 H25 N O4 |
| Smiles: | CCn1c(C)c(C(COc2ccc(C)c(C)c2)=O)c(C)c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.2907 |
| logD: | 4.2907 |
| logSw: | -4.5247 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.61 |
| InChI Key: | KAXGBHNBSUMJEY-UHFFFAOYSA-N |