ethyl [1,7-dimethyl-2,4-dioxo-9-(2-phenylethyl)-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Chemical Structure Depiction of
ethyl [1,7-dimethyl-2,4-dioxo-9-(2-phenylethyl)-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
ethyl [1,7-dimethyl-2,4-dioxo-9-(2-phenylethyl)-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Compound characteristics
| Compound ID: | D389-0977 |
| Compound Name: | ethyl [1,7-dimethyl-2,4-dioxo-9-(2-phenylethyl)-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate |
| Molecular Weight: | 425.49 |
| Molecular Formula: | C22 H27 N5 O4 |
| Smiles: | CCOC(CN1C(c2c(nc3N(CCc4ccccc4)CC(C)Cn23)N(C)C1=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0289 |
| logD: | 3.0287 |
| logSw: | -3.1794 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.504 |
| InChI Key: | XNVBCYJMGHGXNM-HNNXBMFYSA-N |