9-(4-ethoxyphenyl)-1,7-dimethyl-3-(2-oxopropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
9-(4-ethoxyphenyl)-1,7-dimethyl-3-(2-oxopropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-(4-ethoxyphenyl)-1,7-dimethyl-3-(2-oxopropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-0477 |
| Compound Name: | 9-(4-ethoxyphenyl)-1,7-dimethyl-3-(2-oxopropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 411.46 |
| Molecular Formula: | C21 H25 N5 O4 |
| Smiles: | CCOc1ccc(cc1)N1CC(C)Cn2c3C(N(CC(C)=O)C(N(C)c3nc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6256 |
| logD: | 2.6255 |
| logSw: | -2.8736 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.38 |
| InChI Key: | IYTVFZHWKFSSIC-ZDUSSCGKSA-N |