ethyl 1-[3-(2-ethylanilino)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-(2-ethylanilino)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 1-[3-(2-ethylanilino)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-1875 |
| Compound Name: | ethyl 1-[3-(2-ethylanilino)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C25 H28 N2 O3 |
| Smiles: | CCc1ccccc1NC(CCn1c(cc(C(=O)OCC)c1C)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.372 |
| logD: | 5.372 |
| logSw: | -5.3512 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.101 |
| InChI Key: | FVBCDSMURIHKTE-UHFFFAOYSA-N |