3-[(2-chlorophenyl)methyl]-1-methyl-9-phenyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-[(2-chlorophenyl)methyl]-1-methyl-9-phenyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
3-[(2-chlorophenyl)methyl]-1-methyl-9-phenyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-0001 |
| Compound Name: | 3-[(2-chlorophenyl)methyl]-1-methyl-9-phenyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 421.88 |
| Molecular Formula: | C22 H20 Cl N5 O2 |
| Smiles: | CN1C(N(Cc2ccccc2[Cl])C(c2c1nc1N(CCCn12)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3138 |
| logD: | 4.313 |
| logSw: | -4.3086 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.783 |
| InChI Key: | LHKLTMCFRWHPHN-UHFFFAOYSA-N |