7-benzyl-1-(2-methoxyphenyl)-8-methyl-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Chemical Structure Depiction of
7-benzyl-1-(2-methoxyphenyl)-8-methyl-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
7-benzyl-1-(2-methoxyphenyl)-8-methyl-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Compound characteristics
| Compound ID: | Y020-3861 |
| Compound Name: | 7-benzyl-1-(2-methoxyphenyl)-8-methyl-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one |
| Molecular Weight: | 446.55 |
| Molecular Formula: | C26 H30 N4 O3 |
| Smiles: | CC1=C(Cc2ccccc2)C(N2CN(CC3CCCO3)CN(C2=N1)c1ccccc1OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5124 |
| logD: | 3.4893 |
| logSw: | -3.6013 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.863 |
| InChI Key: | HUTPZHYPEXZLSV-OAQYLSRUSA-N |