methyl 2,4-dimethyl-5-{4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperidine-1-carbonyl}-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 2,4-dimethyl-5-{4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperidine-1-carbonyl}-1H-pyrrole-3-carboxylate
methyl 2,4-dimethyl-5-{4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperidine-1-carbonyl}-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | F862-0174 |
| Compound Name: | methyl 2,4-dimethyl-5-{4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperidine-1-carbonyl}-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 466.58 |
| Molecular Formula: | C26 H34 N4 O4 |
| Smiles: | Cc1c(C(=O)OC)c(C)[nH]c1C(N1CCC(CC1)CC(N1CCN(CC1)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.85 |
| logD: | 2.85 |
| logSw: | -3.1824 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.423 |
| InChI Key: | XHBHHCNYVBHQHT-UHFFFAOYSA-N |