methyl 5-{4-[2-(cyclohexylamino)-2-oxoethyl]piperidine-1-carbonyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 5-{4-[2-(cyclohexylamino)-2-oxoethyl]piperidine-1-carbonyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
methyl 5-{4-[2-(cyclohexylamino)-2-oxoethyl]piperidine-1-carbonyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | F862-0256 |
| Compound Name: | methyl 5-{4-[2-(cyclohexylamino)-2-oxoethyl]piperidine-1-carbonyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 403.52 |
| Molecular Formula: | C22 H33 N3 O4 |
| Smiles: | Cc1c(C(=O)OC)c(C)[nH]c1C(N1CCC(CC1)CC(NC1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0776 |
| logD: | 3.0776 |
| logSw: | -3.1031 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.967 |
| InChI Key: | MDSNDTBYCMLWBB-UHFFFAOYSA-N |