methyl 1,3,5-trimethyl-4-[(4-methylphenoxy)acetyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1,3,5-trimethyl-4-[(4-methylphenoxy)acetyl]-1H-pyrrole-2-carboxylate
methyl 1,3,5-trimethyl-4-[(4-methylphenoxy)acetyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V016-9867 |
| Compound Name: | methyl 1,3,5-trimethyl-4-[(4-methylphenoxy)acetyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 315.37 |
| Molecular Formula: | C18 H21 N O4 |
| Smiles: | Cc1ccc(cc1)OCC(c1c(C)c(C(=O)OC)n(C)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0597 |
| logD: | 3.0597 |
| logSw: | -3.1849 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.695 |
| InChI Key: | MYQFCNOPWRUPCH-UHFFFAOYSA-N |