propan-2-yl 2,7,7-trimethyl-4-(6-methyl-4-oxo-4H-1-benzopyran-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2,7,7-trimethyl-4-(6-methyl-4-oxo-4H-1-benzopyran-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
propan-2-yl 2,7,7-trimethyl-4-(6-methyl-4-oxo-4H-1-benzopyran-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 8011-8774 |
| Compound Name: | propan-2-yl 2,7,7-trimethyl-4-(6-methyl-4-oxo-4H-1-benzopyran-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C26 H29 N O5 |
| Smiles: | CC(C)OC(C1C(C2=COc3ccc(C)cc3C2=O)C2=C(CC(C)(C)CC2=O)NC=1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4223 |
| logD: | -0.0539 |
| logSw: | -4.3603 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.247 |
| InChI Key: | WLQKXNWRJSCCFV-QFIPXVFZSA-N |