ethyl 4-{3-[4-(ethoxycarbonyl)anilino]-3-oxopropyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{3-[4-(ethoxycarbonyl)anilino]-3-oxopropyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-{3-[4-(ethoxycarbonyl)anilino]-3-oxopropyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G793-0121 |
| Compound Name: | ethyl 4-{3-[4-(ethoxycarbonyl)anilino]-3-oxopropyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 386.45 |
| Molecular Formula: | C21 H26 N2 O5 |
| Smiles: | CCOC(c1ccc(cc1)NC(CCc1c(C)c(C(=O)OCC)[nH]c1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8657 |
| logD: | 3.8654 |
| logSw: | -4.0362 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.605 |
| InChI Key: | AWJISBKRFPPPNY-UHFFFAOYSA-N |