6-(4-ethylphenyl)-2,9,9-trimethyl-6,9,10,11-tetrahydro[1,2,4]triazolo[5',1':2,3]pyrimido[4,5-b]quinoline-5,7(4H,8H)-dione
Chemical Structure Depiction of
6-(4-ethylphenyl)-2,9,9-trimethyl-6,9,10,11-tetrahydro[1,2,4]triazolo[5',1':2,3]pyrimido[4,5-b]quinoline-5,7(4H,8H)-dione
6-(4-ethylphenyl)-2,9,9-trimethyl-6,9,10,11-tetrahydro[1,2,4]triazolo[5',1':2,3]pyrimido[4,5-b]quinoline-5,7(4H,8H)-dione
Compound characteristics
| Compound ID: | Y020-1486 |
| Compound Name: | 6-(4-ethylphenyl)-2,9,9-trimethyl-6,9,10,11-tetrahydro[1,2,4]triazolo[5',1':2,3]pyrimido[4,5-b]quinoline-5,7(4H,8H)-dione |
| Molecular Weight: | 403.48 |
| Molecular Formula: | C23 H25 N5 O2 |
| Smiles: | CCc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)NC2=C1C(Nc1nc(C)nn12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1925 |
| logD: | 2.3707 |
| logSw: | -3.3326 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.24 |
| InChI Key: | HZHKNLOXOFJJEO-KRWDZBQOSA-N |