ethyl 1-ethyl-3,5-dimethyl-4-{[4-(propan-2-yl)phenyl]carbamoyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 1-ethyl-3,5-dimethyl-4-{[4-(propan-2-yl)phenyl]carbamoyl}-1H-pyrrole-2-carboxylate
ethyl 1-ethyl-3,5-dimethyl-4-{[4-(propan-2-yl)phenyl]carbamoyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C722-0602 |
| Compound Name: | ethyl 1-ethyl-3,5-dimethyl-4-{[4-(propan-2-yl)phenyl]carbamoyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 356.46 |
| Molecular Formula: | C21 H28 N2 O3 |
| Smiles: | CCn1c(C)c(C(Nc2ccc(cc2)C(C)C)=O)c(C)c1C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.889 |
| logD: | 4.8886 |
| logSw: | -4.6655 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.806 |
| InChI Key: | MSXRBQLTNJGJNV-UHFFFAOYSA-N |