ethyl 1-{3-[(2,3-dimethylcyclohexyl)amino]-3-oxopropyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{3-[(2,3-dimethylcyclohexyl)amino]-3-oxopropyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 1-{3-[(2,3-dimethylcyclohexyl)amino]-3-oxopropyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-2014 |
| Compound Name: | ethyl 1-{3-[(2,3-dimethylcyclohexyl)amino]-3-oxopropyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 410.56 |
| Molecular Formula: | C25 H34 N2 O3 |
| Smiles: | CCOC(c1cc(c2ccccc2)n(CCC(NC2CCCC(C)C2C)=O)c1C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0588 |
| logD: | 5.0588 |
| logSw: | -4.5373 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.237 |
| InChI Key: | APXHKDLYGLRZLK-UHFFFAOYSA-N |