9-(4-ethoxyphenyl)-3-[(4-fluorophenyl)methyl]-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
9-(4-ethoxyphenyl)-3-[(4-fluorophenyl)methyl]-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-(4-ethoxyphenyl)-3-[(4-fluorophenyl)methyl]-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-0127 |
| Compound Name: | 9-(4-ethoxyphenyl)-3-[(4-fluorophenyl)methyl]-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 449.48 |
| Molecular Formula: | C24 H24 F N5 O3 |
| Smiles: | CCOc1ccc(cc1)N1CCCn2c3C(N(Cc4ccc(cc4)F)C(N(C)c3nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3495 |
| logD: | 4.3487 |
| logSw: | -4.1183 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.906 |
| InChI Key: | QVEIQLXVWHTMNG-UHFFFAOYSA-N |