methyl 5-{4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 5-{4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
methyl 5-{4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | F862-0179 |
| Compound Name: | methyl 5-{4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 472.63 |
| Molecular Formula: | C26 H40 N4 O4 |
| Smiles: | Cc1c(C(=O)OC)c(C)[nH]c1C(N1CCC(CC1)CC(N1CCN(CC1)C1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8719 |
| logD: | 2.5733 |
| logSw: | -3.0696 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.256 |
| InChI Key: | NPFPEFMUYPEGTC-UHFFFAOYSA-N |