ethyl 1-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 1-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-1562 |
| Compound Name: | ethyl 1-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 459.59 |
| Molecular Formula: | C28 H33 N3 O3 |
| Smiles: | CCOC(c1cc(c2ccccc2)n(CC(N2CCN(CC2)c2cc(C)ccc2C)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7098 |
| logD: | 5.7097 |
| logSw: | -5.5232 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.023 |
| InChI Key: | VIKNFQIBRATXND-UHFFFAOYSA-N |