3-[(4-fluorophenyl)methyl]-1-methyl-9-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-[(4-fluorophenyl)methyl]-1-methyl-9-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
3-[(4-fluorophenyl)methyl]-1-methyl-9-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-0816 |
| Compound Name: | 3-[(4-fluorophenyl)methyl]-1-methyl-9-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 433.48 |
| Molecular Formula: | C24 H24 F N5 O2 |
| Smiles: | CN1C(N(Cc2ccc(cc2)F)C(c2c1nc1N(CCCn12)CCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.133 |
| logD: | 4.1314 |
| logSw: | -4.14 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.207 |
| InChI Key: | NHOINGZNCKQZGB-UHFFFAOYSA-N |