1-benzyl-5-(4-hydroxy-3-methoxyphenyl)-8,8-dimethyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione
Chemical Structure Depiction of
1-benzyl-5-(4-hydroxy-3-methoxyphenyl)-8,8-dimethyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione
1-benzyl-5-(4-hydroxy-3-methoxyphenyl)-8,8-dimethyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione
Compound characteristics
| Compound ID: | 8014-9481 |
| Compound Name: | 1-benzyl-5-(4-hydroxy-3-methoxyphenyl)-8,8-dimethyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione |
| Molecular Weight: | 473.53 |
| Molecular Formula: | C27 H27 N3 O5 |
| Smiles: | CC1(C)CC2=C(C(C3=C(N2)N(Cc2ccccc2)C(NC3=O)=O)c2ccc(c(c2)OC)O)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2623 |
| logD: | 1.6842 |
| logSw: | -3.3715 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.415 |
| InChI Key: | GCJIGMCXSBONMD-OAQYLSRUSA-N |