ethyl 3,5-dimethyl-4-{4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperidine-1-carbonyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-{4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperidine-1-carbonyl}-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-{4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperidine-1-carbonyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F861-0041 |
| Compound Name: | ethyl 3,5-dimethyl-4-{4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperidine-1-carbonyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 480.61 |
| Molecular Formula: | C27 H36 N4 O4 |
| Smiles: | CCOC(c1c(C)c(C(N2CCC(CC2)CC(N2CCN(CC2)c2ccccc2)=O)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.271 |
| logD: | 3.2709 |
| logSw: | -3.2378 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.003 |
| InChI Key: | GXKCWZSOKCXOBN-UHFFFAOYSA-N |