methyl 4-(7,7-dimethyl-2,5-dioxo-1,2,3,4,5,6,7,8-octahydroquinolin-4-yl)benzoate
Chemical Structure Depiction of
methyl 4-(7,7-dimethyl-2,5-dioxo-1,2,3,4,5,6,7,8-octahydroquinolin-4-yl)benzoate
methyl 4-(7,7-dimethyl-2,5-dioxo-1,2,3,4,5,6,7,8-octahydroquinolin-4-yl)benzoate
Compound characteristics
| Compound ID: | C276-0776 |
| Compound Name: | methyl 4-(7,7-dimethyl-2,5-dioxo-1,2,3,4,5,6,7,8-octahydroquinolin-4-yl)benzoate |
| Molecular Weight: | 327.38 |
| Molecular Formula: | C19 H21 N O4 |
| Smiles: | CC1(C)CC2=C(C(CC(N2)=O)c2ccc(cc2)C(=O)OC)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4524 |
| logD: | 1.3691 |
| logSw: | -2.872 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.18 |
| InChI Key: | LRDAHSGOXMGNIS-CYBMUJFWSA-N |