ethyl 4-[3-({2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}amino)-3-oxopropyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[3-({2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}amino)-3-oxopropyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[3-({2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}amino)-3-oxopropyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G793-0816 |
| Compound Name: | ethyl 4-[3-({2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}amino)-3-oxopropyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 458.58 |
| Molecular Formula: | C25 H35 F N4 O3 |
| Smiles: | CCOC(c1c(C)c(CCC(NCCN2CCN(CC2)c2ccccc2F)=O)c(C)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5771 |
| logD: | 2.5232 |
| logSw: | -2.7763 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.784 |
| InChI Key: | VYWMZYKSJPSSAB-UHFFFAOYSA-N |