2-[9-(3,5-dimethylphenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetamide
Chemical Structure Depiction of
2-[9-(3,5-dimethylphenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetamide
2-[9-(3,5-dimethylphenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetamide
Compound characteristics
| Compound ID: | D389-0642 |
| Compound Name: | 2-[9-(3,5-dimethylphenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetamide |
| Molecular Weight: | 396.45 |
| Molecular Formula: | C20 H24 N6 O3 |
| Smiles: | CC1CN(c2cc(C)cc(C)c2)c2nc3c(C(N(CC(N)=O)C(N3C)=O)=O)n2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4526 |
| logD: | 2.4493 |
| logSw: | -2.4053 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.309 |
| InChI Key: | XDYVNQPJJUSVRI-ZDUSSCGKSA-N |