ethyl 1-[3-(4-cyclohexylpiperazin-1-yl)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-(4-cyclohexylpiperazin-1-yl)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 1-[3-(4-cyclohexylpiperazin-1-yl)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-2186 |
| Compound Name: | ethyl 1-[3-(4-cyclohexylpiperazin-1-yl)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 451.61 |
| Molecular Formula: | C27 H37 N3 O3 |
| Smiles: | CCOC(c1cc(c2ccccc2)n(CCC(N2CCN(CC2)C2CCCCC2)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6759 |
| logD: | 4.3773 |
| logSw: | -4.3258 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.136 |
| InChI Key: | AGSPESAVLFIMPT-UHFFFAOYSA-N |