9-(3-chloro-4-methylphenyl)-1-methyl-3-[(2-methylphenyl)methyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
9-(3-chloro-4-methylphenyl)-1-methyl-3-[(2-methylphenyl)methyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-(3-chloro-4-methylphenyl)-1-methyl-3-[(2-methylphenyl)methyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-1019 |
| Compound Name: | 9-(3-chloro-4-methylphenyl)-1-methyl-3-[(2-methylphenyl)methyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 449.94 |
| Molecular Formula: | C24 H24 Cl N5 O2 |
| Smiles: | Cc1ccccc1CN1C(c2c(nc3N(CCCn23)c2ccc(C)c(c2)[Cl])N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7999 |
| logD: | 5.7991 |
| logSw: | -5.9033 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.783 |
| InChI Key: | WOHJKOHTTZICBD-UHFFFAOYSA-N |