ethyl 5-(4-fluorophenyl)-2-methyl-1-{3-[(4-methylcyclohexyl)amino]-3-oxopropyl}-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(4-fluorophenyl)-2-methyl-1-{3-[(4-methylcyclohexyl)amino]-3-oxopropyl}-1H-pyrrole-3-carboxylate
ethyl 5-(4-fluorophenyl)-2-methyl-1-{3-[(4-methylcyclohexyl)amino]-3-oxopropyl}-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-3313 |
| Compound Name: | ethyl 5-(4-fluorophenyl)-2-methyl-1-{3-[(4-methylcyclohexyl)amino]-3-oxopropyl}-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 414.52 |
| Molecular Formula: | C24 H31 F N2 O3 |
| Smiles: | CCOC(c1cc(c2ccc(cc2)F)n(CCC(NC2CCC(C)CC2)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8596 |
| logD: | 5.8596 |
| logSw: | -5.5065 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.847 |
| InChI Key: | QBSPHTVWBIMZEQ-UHFFFAOYSA-N |