ethyl 1-[3-(3-acetylanilino)-3-oxopropyl]-5-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-(3-acetylanilino)-3-oxopropyl]-5-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylate
ethyl 1-[3-(3-acetylanilino)-3-oxopropyl]-5-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-3144 |
| Compound Name: | ethyl 1-[3-(3-acetylanilino)-3-oxopropyl]-5-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 436.48 |
| Molecular Formula: | C25 H25 F N2 O4 |
| Smiles: | CCOC(c1cc(c2ccc(cc2)F)n(CCC(Nc2cccc(c2)C(C)=O)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7475 |
| logD: | 4.7471 |
| logSw: | -4.3261 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.626 |
| InChI Key: | VWIOMZYBZKBLCB-UHFFFAOYSA-N |