ethyl 1-[3-(4-cyclopentylpiperazin-1-yl)-3-oxopropyl]-5-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-(4-cyclopentylpiperazin-1-yl)-3-oxopropyl]-5-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylate
ethyl 1-[3-(4-cyclopentylpiperazin-1-yl)-3-oxopropyl]-5-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-3146 |
| Compound Name: | ethyl 1-[3-(4-cyclopentylpiperazin-1-yl)-3-oxopropyl]-5-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 455.57 |
| Molecular Formula: | C26 H34 F N3 O3 |
| Smiles: | CCOC(c1cc(c2ccc(cc2)F)n(CCC(N2CCN(CC2)C2CCCC2)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2634 |
| logD: | 3.8199 |
| logSw: | -4.1677 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.502 |
| InChI Key: | ADUVAJNDTIRPRC-UHFFFAOYSA-N |