prop-2-en-1-yl 2,7,7-trimethyl-5-oxo-4-{2-[(propan-2-yl)oxy]phenyl}-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl 2,7,7-trimethyl-5-oxo-4-{2-[(propan-2-yl)oxy]phenyl}-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
prop-2-en-1-yl 2,7,7-trimethyl-5-oxo-4-{2-[(propan-2-yl)oxy]phenyl}-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 1630-1410 |
| Compound Name: | prop-2-en-1-yl 2,7,7-trimethyl-5-oxo-4-{2-[(propan-2-yl)oxy]phenyl}-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C25 H31 N O4 |
| Smiles: | CC(C)Oc1ccccc1C1C(=C(C)NC2CC(C)(C)CC(C1=2)=O)C(=O)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6019 |
| logD: | 0.5722 |
| logSw: | -4.5357 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.858 |
| InChI Key: | XCGHYDJAAMSQJU-QFIPXVFZSA-N |