ethyl 1-[3-(cyclooctylamino)-3-oxopropyl]-2-methyl-5-(4-methylphenyl)-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-(cyclooctylamino)-3-oxopropyl]-2-methyl-5-(4-methylphenyl)-1H-pyrrole-3-carboxylate
ethyl 1-[3-(cyclooctylamino)-3-oxopropyl]-2-methyl-5-(4-methylphenyl)-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | C721-0634 |
| Compound Name: | ethyl 1-[3-(cyclooctylamino)-3-oxopropyl]-2-methyl-5-(4-methylphenyl)-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 424.58 |
| Molecular Formula: | C26 H36 N2 O3 |
| Smiles: | CCOC(c1cc(c2ccc(C)cc2)n(CCC(NC2CCCCCCC2)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4373 |
| logD: | 6.4373 |
| logSw: | -5.5513 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.178 |
| InChI Key: | PXDQTEBMXBFAMX-UHFFFAOYSA-N |