methyl 4-(1,3-dimethyl-2,4,6-trioxo-1,2,3,4,5,6,7,8,9,10-decahydropyrimido[4,5-b]quinolin-5-yl)benzoate
Chemical Structure Depiction of
methyl 4-(1,3-dimethyl-2,4,6-trioxo-1,2,3,4,5,6,7,8,9,10-decahydropyrimido[4,5-b]quinolin-5-yl)benzoate
methyl 4-(1,3-dimethyl-2,4,6-trioxo-1,2,3,4,5,6,7,8,9,10-decahydropyrimido[4,5-b]quinolin-5-yl)benzoate
Compound characteristics
| Compound ID: | 7399-0604 |
| Compound Name: | methyl 4-(1,3-dimethyl-2,4,6-trioxo-1,2,3,4,5,6,7,8,9,10-decahydropyrimido[4,5-b]quinolin-5-yl)benzoate |
| Molecular Weight: | 395.41 |
| Molecular Formula: | C21 H21 N3 O5 |
| Smiles: | CN1C2=C(C(C3=C(CCCC3=O)N2)c2ccc(cc2)C(=O)OC)C(N(C)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2425 |
| logD: | 0.2556 |
| logSw: | -2.8855 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.533 |
| InChI Key: | VNHUFOOFCGSNPJ-OAHLLOKOSA-N |