ethyl [9-(4-methoxyphenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Chemical Structure Depiction of
ethyl [9-(4-methoxyphenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
ethyl [9-(4-methoxyphenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Compound characteristics
| Compound ID: | D389-0452 |
| Compound Name: | ethyl [9-(4-methoxyphenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate |
| Molecular Weight: | 427.46 |
| Molecular Formula: | C21 H25 N5 O5 |
| Smiles: | CCOC(CN1C(c2c(nc3N(CC(C)Cn23)c2ccc(cc2)OC)N(C)C1=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8307 |
| logD: | 2.8306 |
| logSw: | -3.1836 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.624 |
| InChI Key: | LGJMDZIMWOESRL-ZDUSSCGKSA-N |