ethyl 5-[3-(3,5-dimethylanilino)-3-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[3-(3,5-dimethylanilino)-3-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
ethyl 5-[3-(3,5-dimethylanilino)-3-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G726-1159 |
| Compound Name: | ethyl 5-[3-(3,5-dimethylanilino)-3-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 342.44 |
| Molecular Formula: | C20 H26 N2 O3 |
| Smiles: | CCOC(c1c(C)c(CCC(Nc2cc(C)cc(C)c2)=O)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6258 |
| logD: | 3.6258 |
| logSw: | -3.8736 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.347 |
| InChI Key: | NKNNOSAUZUETMR-UHFFFAOYSA-N |