cyclopentyl 4-(2-butoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
cyclopentyl 4-(2-butoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
cyclopentyl 4-(2-butoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 1921-2253 |
| Compound Name: | cyclopentyl 4-(2-butoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 451.61 |
| Molecular Formula: | C28 H37 N O4 |
| Smiles: | CCCCOc1ccccc1C1C(=C(C)NC2CC(C)(C)CC(C1=2)=O)C(=O)OC1CCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3612 |
| logD: | 2.074 |
| logSw: | -5.5692 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.875 |
| InChI Key: | MLKWXTPVHFBNIX-VWLOTQADSA-N |